N,N-dimethyl-1-[(4-methylphenyl)methyl]pyrrolidin-3-amine;N,N-dimethyl-1-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]pyrrolidin-3-amine;1-methyl-4-[(4-methylphenyl)methyl]piperazine;4-methyl-1-[3-methyl-5-(trifluoromethyl)phenyl]imidazole;1-methyl-4-[[3-methyl-5-(trifluoromethyl)phenyl]methyl]piperazine;1-methyl-4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]piperazine;1-methyl-4-[3-methyl-5-(trifluoromethyl)phenyl]piperazine;1-methyl-3-propan-2-ylbenzene;1-methyl-3-(trifluoromethoxy)benzene;1-methyl-3-(trifluoromethyl)benzene;4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]morpholine;1-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]piperazine;3-methyl-5-(trifluoromethyl)pyridine;N,N,3-trimethyl-5-(trifluoromethyl)aniline

C164H208F33N19O2 — CID 161382636

IUPACN,N-dimethyl-1-[(4-methylphenyl)methyl]pyrrolidin-3-amine;N,N-dimethyl-1-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]pyrrolidin-3-amine;1-methyl-4-[(4-methylphenyl)methyl]piperazine;4-methyl-1-[3-methyl-5-(trifluoromethyl)phenyl]imidazole;1-methyl-4-[[3-methyl-5-(trifluoromethyl)phenyl]methyl]piperazine;1-methyl-4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]piperazine;1-methyl-4-[3-methyl-5-(trifluoromethyl)phenyl]piperazine;1-methyl-3-propan-2-ylbenzene;1-methyl-3-(trifluoromethoxy)benzene;1-methyl-3-(trifluoromethyl)benzene;4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]morpholine;1-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]piperazine;3-methyl-5-(trifluoromethyl)pyridine;N,N,3-trimethyl-5-(trifluoromethyl)aniline
SMILESCc1cc(-n2cnc(C)c2)cc(C(F)(F)F)c1.Cc1cc(CN2CCN(C)CC2)cc(C(F)(F)F)c1.Cc1cc(N(C)C)cc(C(F)(F)F)c1.Cc1cc(N2CCN(C)CC2)cc(C(F)(F)F)c1.Cc1ccc(CN2CCC(N(C)C)C2)c(C(F)(F)F)c1.Cc1ccc(CN2CCC(N(C)C)C2)cc1.Cc1ccc(CN2CCN(C)CC2)c(C(F)(F)F)c1.Cc1ccc(CN2CCN(C)CC2)cc1.Cc1ccc(CN2CCNCC2)c(C(F)(F)F)c1.Cc1ccc(CN2CCOCC2)c(C(F)(F)F)c1.Cc1cccc(C(C)C)c1.Cc1cccc(C(F)(F)F)c1.Cc1cccc(OC(F)(F)F)c1.Cc1cncc(C(F)(F)F)c1
InChIInChI=1S/C15H21F3N2.2C14H19F3N2.C14H22N2.2C13H17F3N2.C13H16F3NO.C13H20N2.C12H11F3N2.C10H12F3N.C10H14.C8H7F3O.C8H7F3.C7H6F3N/c1-11-4-5-12(14(8-11)15(16,17)18)9-20-7-6-13(10-20)19(2)3;1-11-7-12(9-13(8-11)14(15,16)17)10-19-5-3-18(2)4-6-19;1-11-3-4-12(13(9-11)14(15,16)17)10-19-7-5-18(2)6-8-19;1-12-4-6-13(7-5-12)10-16-9-8-14(11-16)15(2)3;1-10-7-11(13(14,15)16)9-12(8-10)18-5-3-17(2)4-6-18;1-10-2-3-11(12(8-10)13(14,15)16)9-18-6-4-17-5-7-18;1-10-2-3-11(12(8-10)13(14,15)16)9-17-4-6-18-7-5-17;1-12-3-5-13(6-4-12)11-15-9-7-14(2)8-10-15;1-8-3-10(12(13,14)15)5-11(4-8)17-6-9(2)16-7-17;1-7-4-8(10(11,12)13)6-9(5-7)14(2)3;1-8(2)10-6-4-5-9(3)7-10;1-6-3-2-4-7(5-6)12-8(9,10)11;1-6-3-2-4-7(5-6)8(9,10)11;1-5-2-6(4-11-3-5)7(8,9)10/h4-5,8,13H,6-7,9-10H2,1-3H3;7-9H,3-6,10H2,1-2H3;3-4,9H,5-8,10H2,1-2H3;4-7,14H,8-11H2,1-3H3;7-9H,3-6H2,1-2H3;2-3,8,17H,4-7,9H2,1H3;2-3,8H,4-7,9H2,1H3;3-6H,7-11H2,1-2H3;3-7H,1-2H3;4-6H,1-3H3;4-8H,1-3H3;2-5H,1H3;2-5H,1H3;2-4H,1H3
InChIKeyVRXNPFXQXBFUPV-UHFFFAOYSA-N
MW3104.53 g/mol
LogP38.60
Rot. Bonds21

About N,N-dimethyl-1-[(4-methylphenyl)methyl]pyrrolidin-3-amine;N,N-dimethyl-1-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]pyrrolidin-3-amine;1-methyl-4-[(4-methylphenyl)methyl]piperazine;4-methyl-1-[3-methyl-5-(trifluoromethyl)phenyl]imidazole;1-methyl-4-[[3-methyl-5-(trifluoromethyl)phenyl]methyl]piperazine;1-methyl-4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]piperazine;1-methyl-4-[3-methyl-5-(trifluoromethyl)phenyl]piperazine;1-methyl-3-propan-2-ylbenzene;1-methyl-3-(trifluoromethoxy)benzene;1-methyl-3-(trifluoromethyl)benzene;4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]morpholine;1-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]piperazine;3-methyl-5-(trifluoromethyl)pyridine;N,N,3-trimethyl-5-(trifluoromethyl)aniline

N,N-dimethyl-1-[(4-methylphenyl)methyl]pyrrolidin-3-amine;N,N-dimethyl-1-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]pyrrolidin-3-amine;1-methyl-4-[(4-methylphenyl)methyl]piperazine;4-methyl-1-[3-methyl-5-(trifluoromethyl)phenyl]imidazole;1-methyl-4-[[3-methyl-5-(trifluoromethyl)phenyl]methyl]piperazine;1-methyl-4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]piperazine;1-methyl-4-[3-methyl-5-(trifluoromethyl)phenyl]piperazine;1-methyl-3-propan-2-ylbenzene;1-methyl-3-(trifluoromethoxy)benzene;1-methyl-3-(trifluoromethyl)benzene;4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]morpholine;1-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]piperazine;3-methyl-5-(trifluoromethyl)pyridine;N,N,3-trimethyl-5-(trifluoromethyl)aniline (PubChem CID 161382636) has the molecular formula C164H208F33N19O2 and a molecular weight of 3104.53 g/mol. Its IUPAC name is N,N-dimethyl-1-[(4-methylphenyl)methyl]pyrrolidin-3-amine;N,N-dimethyl-1-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]pyrrolidin-3-amine;1-methyl-4-[(4-methylphenyl)methyl]piperazine;4-methyl-1-[3-methyl-5-(trifluoromethyl)phenyl]imidazole;1-methyl-4-[[3-methyl-5-(trifluoromethyl)phenyl]methyl]piperazine;1-methyl-4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]piperazine;1-methyl-4-[3-methyl-5-(trifluoromethyl)phenyl]piperazine;1-methyl-3-propan-2-ylbenzene;1-methyl-3-(trifluoromethoxy)benzene;1-methyl-3-(trifluoromethyl)benzene;4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]morpholine;1-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]piperazine;3-methyl-5-(trifluoromethyl)pyridine;N,N,3-trimethyl-5-(trifluoromethyl)aniline.

Molecular Properties

Compound NameN,N-dimethyl-1-[(4-methylphenyl)methyl]pyrrolidin-3-amine;N,N-dimethyl-1-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]pyrrolidin-3-amine;1-methyl-4-[(4-methylphenyl)methyl]piperazine;4-methyl-1-[3-methyl-5-(trifluoromethyl)phenyl]imidazole;1-methyl-4-[[3-methyl-5-(trifluoromethyl)phenyl]methyl]piperazine;1-methyl-4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]piperazine;1-methyl-4-[3-methyl-5-(trifluoromethyl)phenyl]piperazine;1-methyl-3-propan-2-ylbenzene;1-methyl-3-(trifluoromethoxy)benzene;1-methyl-3-(trifluoromethyl)benzene;4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]morpholine;1-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]piperazine;3-methyl-5-(trifluoromethyl)pyridine;N,N,3-trimethyl-5-(trifluoromethyl)aniline
PubChem CID161382636
Molecular FormulaC164H208F33N19O2
Molecular Weight3104.53 g/mol
Exact Mass3102.62
IUPAC NameN,N-dimethyl-1-[(4-methylphenyl)methyl]pyrrolidin-3-amine;N,N-dimethyl-1-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]pyrrolidin-3-amine;1-methyl-4-[(4-methylphenyl)methyl]piperazine;4-methyl-1-[3-methyl-5-(trifluoromethyl)phenyl]imidazole;1-methyl-4-[[3-methyl-5-(trifluoromethyl)phenyl]methyl]piperazine;1-methyl-4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]piperazine;1-methyl-4-[3-methyl-5-(trifluoromethyl)phenyl]piperazine;1-methyl-3-propan-2-ylbenzene;1-methyl-3-(trifluoromethoxy)benzene;1-methyl-3-(trifluoromethyl)benzene;4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]morpholine;1-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]piperazine;3-methyl-5-(trifluoromethyl)pyridine;N,N,3-trimethyl-5-(trifluoromethyl)aniline
SMILESCc1cc(-n2cnc(C)c2)cc(C(F)(F)F)c1.Cc1cc(CN2CCN(C)CC2)cc(C(F)(F)F)c1.Cc1cc(N(C)C)cc(C(F)(F)F)c1.Cc1cc(N2CCN(C)CC2)cc(C(F)(F)F)c1.Cc1ccc(CN2CCC(N(C)C)C2)c(C(F)(F)F)c1.Cc1ccc(CN2CCC(N(C)C)C2)cc1.Cc1ccc(CN2CCN(C)CC2)c(C(F)(F)F)c1.Cc1ccc(CN2CCN(C)CC2)cc1.Cc1ccc(CN2CCNCC2)c(C(F)(F)F)c1.Cc1ccc(CN2CCOCC2)c(C(F)(F)F)c1.Cc1cccc(C(C)C)c1.Cc1cccc(C(F)(F)F)c1.Cc1cccc(OC(F)(F)F)c1.Cc1cncc(C(F)(F)F)c1
InChIInChI=1S/C15H21F3N2.2C14H19F3N2.C14H22N2.2C13H17F3N2.C13H16F3NO.C13H20N2.C12H11F3N2.C10H12F3N.C10H14.C8H7F3O.C8H7F3.C7H6F3N/c1-11-4-5-12(14(8-11)15(16,17)18)9-20-7-6-13(10-20)19(2)3;1-11-7-12(9-13(8-11)14(15,16)17)10-19-5-3-18(2)4-6-19;1-11-3-4-12(13(9-11)14(15,16)17)10-19-7-5-18(2)6-8-19;1-12-4-6-13(7-5-12)10-16-9-8-14(11-16)15(2)3;1-10-7-11(13(14,15)16)9-12(8-10)18-5-3-17(2)4-6-18;1-10-2-3-11(12(8-10)13(14,15)16)9-18-6-4-17-5-7-18;1-10-2-3-11(12(8-10)13(14,15)16)9-17-4-6-18-7-5-17;1-12-3-5-13(6-4-12)11-15-9-7-14(2)8-10-15;1-8-3-10(12(13,14)15)5-11(4-8)17-6-9(2)16-7-17;1-7-4-8(10(11,12)13)6-9(5-7)14(2)3;1-8(2)10-6-4-5-9(3)7-10;1-6-3-2-4-7(5-6)12-8(9,10)11;1-6-3-2-4-7(5-6)8(9,10)11;1-5-2-6(4-11-3-5)7(8,9)10/h4-5,8,13H,6-7,9-10H2,1-3H3;7-9H,3-6,10H2,1-2H3;3-4,9H,5-8,10H2,1-2H3;4-7,14H,8-11H2,1-3H3;7-9H,3-6H2,1-2H3;2-3,8,17H,4-7,9H2,1H3;2-3,8H,4-7,9H2,1H3;3-6H,7-11H2,1-2H3;3-7H,1-2H3;4-6H,1-3H3;4-8H,1-3H3;2-5H,1H3;2-5H,1H3;2-4H,1H3
InChIKeyVRXNPFXQXBFUPV-UHFFFAOYSA-N
XLogP38.60
TPSA109.80 Ų
H-Bond Donors1
H-Bond Acceptors21
Rotatable Bonds21
Heavy Atoms218
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003104.53
LogP ≤ 538.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1021

Analyze N,N-dimethyl-1-[(4-methylphenyl)methyl]pyrrolidin-3-amine;N,N-dimethyl-1-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]pyrrolidin-3-amine;1-methyl-4-[(4-methylphenyl)methyl]piperazine;4-methyl-1-[3-methyl-5-(trifluoromethyl)phenyl]imidazole;1-methyl-4-[[3-methyl-5-(trifluoromethyl)phenyl]methyl]piperazine;1-methyl-4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]piperazine;1-methyl-4-[3-methyl-5-(trifluoromethyl)phenyl]piperazine;1-methyl-3-propan-2-ylbenzene;1-methyl-3-(trifluoromethoxy)benzene;1-methyl-3-(trifluoromethyl)benzene;4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]morpholine;1-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]piperazine;3-methyl-5-(trifluoromethyl)pyridine;N,N,3-trimethyl-5-(trifluoromethyl)aniline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-chloro-4-methyl-2-(trifluoromethyl)benzene;1,3-dimethyl-5-(trifluoromethyl)benzene;1-ethyl-4-[[3-methyl-5-(trifluoromethyl)phenyl]methyl]piperazine;1-ethyl-4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]piperazine;methylcyclopentane;1-methyl-4-[3-methyl-5-(trifluoromethyl)phenoxy]piperidine;2-methyl-1-[3-methyl-5-(trifluoromethyl)phenyl]imidazole;4-methyl-1-[3-methyl-5-(trifluoromethyl)phenyl]imidazole;5-methyl-1-[3-methyl-5-(trifluoromethyl)phenyl]imidazole;1-methyl-4-[3-methyl-5-(trifluoromethyl)phenyl]piperazine;1-methyl-4-[4-methyl-2-(trifluoromethyl)phenyl]piperazine;1-(4-methylpiperidin-1-yl)ethanone;4-[3-methyl-5-(trifluoromethyl)phenyl]morpholine;1-[4-methyl-2-(trifluoromethyl)phenyl]piperidine
CID 167562878
1-tert-butyl-3-methylbenzene;1-(3-tert-butyl-5-methylphenyl)-4-methylimidazole;1-[(3-tert-butyl-5-methylphenyl)methyl]-4-methylpiperazine;1-[(4-tert-butyl-2-methylphenyl)methyl]-4-methylpiperazine;5-[(4-tert-butyl-2-methylphenyl)methyl]-N-methylpyridine-2-carboxamide;1-[5-[(4-tert-butyl-2-methylphenyl)methyl]-2-pyridinyl]ethanone;1-[5-[(4-tert-butyl-2-methylphenyl)methyl]-3-pyridinyl]ethanone;1-tert-butyl-3-methyl-5-(trifluoromethyl)benzene
CID 160554510
1-(1,1-difluoroethoxy)-3-methylbenzene;3-(1,1-difluoroethyl)-5-methylpyridine;1-[(3,5-dimethylphenyl)methyl]-4-methylpiperazine;1,3-dimethyl-5-(trifluoromethyl)benzene;1-methoxy-3-methylbenzene;2-methyl-2-(3-methylphenyl)propanenitrile;1-methyl-4-[[3-methyl-5-(trifluoromethyl)phenyl]methyl]piperazine;N-[[3-methyl-5-(trifluoromethyl)phenyl]methyl]cyclopropanamine;1-[[3-methyl-5-(trifluoromethyl)phenyl]methyl]piperidine
CID 157440179
ethane;4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]morpholine
CID 144816585
2-N,4-N,4-N-trimethyl-2-N-[1-[[3-(trifluoromethoxy)phenyl]methyl]piperidin-3-yl]pyrimidine-2,4-diamine
CID 172892048
1-ethyl-4-[(4-propan-2-ylphenyl)methyl]piperazine;1-methyl-4-[(4-propan-2-ylphenyl)methyl]piperazine;1-methyl-4-(4-propan-2-ylphenyl)piperazine;1-methyl-4-(4-propan-2-ylphenyl)piperidine;4-[(4-propan-2-ylphenyl)methyl]morpholine;4-(3-propan-2-ylphenyl)morpholine;4-(4-propan-2-ylphenyl)morpholine;1-(4-propan-2-ylphenyl)piperazine;1-(4-propan-2-ylphenyl)piperidin-4-ol;4-[3-(4-propan-2-ylphenyl)propyl]morpholine
CID 159280853
1-[[4-[(2-methylpropan-2-yl)oxy]phenyl]methyl]-4-[3-(trifluoromethyl)phenyl]piperazine
CID 3867916
1-[(3-tert-butyl-5-cyclopropylphenyl)methyl]-4-methylpiperazine;4-tert-butyl-N-[(1-ethylpyrrolidin-2-yl)methyl]benzamide;1-tert-butyl-3-fluoro-2-propan-2-yloxybenzene;1-[(3-tert-butylphenyl)methoxy]-4-methyl-2-propan-2-ylbenzene;(3R)-1-[[3-tert-butyl-5-(trifluoromethyl)phenyl]methyl]-N,N-dimethylpyrrolidin-3-amine;1-[[4-tert-butyl-2-(trifluoromethyl)phenyl]methyl]-4-(2-fluoroethyl)piperazine;1-[[4-tert-butyl-2-(trifluoromethyl)phenyl]methyl]-3-methylpiperazine;(3R)-1-[[3-tert-butyl-5-(trifluoromethyl)phenyl]methyl]pyrrolidin-3-ol
CID 160819183
2-N-[[2-[bis(cyclopropylmethyl)amino]-8-methylquinolin-3-yl]methyl]-5-N,5-N-dimethyl-2-N-[[3-methyl-5-(trifluoromethyl)phenyl]methyl]pyrimidine-2,5-diamine;N,N-bis(cyclopropylmethyl)-3-[[(5-ethylpyrimidin-2-yl)-[[3-methyl-5-(trifluoromethyl)phenyl]methyl]amino]methyl]-8-methylquinolin-2-amine;N,N-bis(cyclopropylmethyl)-8-methyl-3-[[[5-(4-methylpiperazin-1-yl)pyrimidin-2-yl]-[[3-methyl-5-(trifluoromethyl)phenyl]methyl]amino]methyl]quinolin-2-amine;N,N-bis(cyclopropylmethyl)-8-methyl-3-[[[3-methyl-5-(trifluoromethyl)phenyl]methyl-(5-morpholin-4-ylpyrimidin-2-yl)amino]methyl]quinolin-2-amine
CID 162240519
N-methyl-2-morpholin-4-yl-N-[1-[[3-(trifluoromethyl)phenyl]methyl]pyrrolidin-3-yl]pyrimidin-4-amine
CID 172902281
2-tert-butyl-1-chloro-4-methylbenzene;2,5-dimethyl-1-(4-methylpentyl)-3-(trifluoromethyl)benzene;4-[2,5-dimethyl-3-(trifluoromethyl)phenyl]-1-methyl-3,6-dihydro-2H-pyridine;1-[[2,5-dimethyl-3-(trifluoromethyl)phenyl]methyl]pyrrolidine;4-[2,3-dimethyl-5-(trifluoromethyl)phenyl]-1,4-oxazepane;4-[2,5-dimethyl-3-(trifluoromethyl)phenyl]-1,2,3,6-tetrahydropyridine;1-(2-methoxyethyl)-4-[3-methyl-5-(trifluoromethoxy)phenyl]piperazine;2-methyl-4-[3-methyl-5-(trifluoromethyl)phenyl]morpholine
CID 160606787
N,N-dimethyl-2-(2-propan-2-ylpyrimidin-5-yl)oxyethanamine;5-[(4-methylpiperazin-1-yl)methyl]-2-propan-2-ylpyrimidine;5-(4-methylpiperazin-1-yl)-2-propan-2-ylpyrimidine;3-methyl-5-propan-2-yl-1,2,4-oxadiazole;2-methyl-4-propan-2-yl-6-(trifluoromethyl)pyrimidine;5-(piperazin-1-ylmethyl)-2-propan-2-ylpyrimidine;2-propan-2-ylpyrazine;5-propan-2-ylpyrimidine;4-[(2-propan-2-ylpyrimidin-5-yl)methyl]morpholine;4-(2-propan-2-ylpyrimidin-4-yl)morpholine;4-(2-propan-2-ylpyrimidin-5-yl)morpholine
CID 160922525

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-[(4-methylphenyl)methyl]pyrrolidin-3-amine;N,N-dimethyl-1-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]pyrrolidin-3-amine;1-methyl-4-[(4-methylphenyl)methyl]piperazine;4-methyl-1-[3-methyl-5-(trifluoromethyl)phenyl]imidazole;1-methyl-4-[[3-methyl-5-(trifluoromethyl)phenyl]methyl]piperazine;1-methyl-4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]piperazine;1-methyl-4-[3-methyl-5-(trifluoromethyl)phenyl]piperazine;1-methyl-3-propan-2-ylbenzene;1-methyl-3-(trifluoromethoxy)benzene;1-methyl-3-(trifluoromethyl)benzene;4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]morpholine;1-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]piperazine;3-methyl-5-(trifluoromethyl)pyridine;N,N,3-trimethyl-5-(trifluoromethyl)aniline?
The IUPAC name of N,N-dimethyl-1-[(4-methylphenyl)methyl]pyrrolidin-3-amine;N,N-dimethyl-1-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]pyrrolidin-3-amine;1-methyl-4-[(4-methylphenyl)methyl]piperazine;4-methyl-1-[3-methyl-5-(trifluoromethyl)phenyl]imidazole;1-methyl-4-[[3-methyl-5-(trifluoromethyl)phenyl]methyl]piperazine;1-methyl-4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]piperazine;1-methyl-4-[3-methyl-5-(trifluoromethyl)phenyl]piperazine;1-methyl-3-propan-2-ylbenzene;1-methyl-3-(trifluoromethoxy)benzene;1-methyl-3-(trifluoromethyl)benzene;4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]morpholine;1-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]piperazine;3-methyl-5-(trifluoromethyl)pyridine;N,N,3-trimethyl-5-(trifluoromethyl)aniline (CID 161382636) is N,N-dimethyl-1-[(4-methylphenyl)methyl]pyrrolidin-3-amine;N,N-dimethyl-1-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]pyrrolidin-3-amine;1-methyl-4-[(4-methylphenyl)methyl]piperazine;4-methyl-1-[3-methyl-5-(trifluoromethyl)phenyl]imidazole;1-methyl-4-[[3-methyl-5-(trifluoromethyl)phenyl]methyl]piperazine;1-methyl-4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]piperazine;1-methyl-4-[3-methyl-5-(trifluoromethyl)phenyl]piperazine;1-methyl-3-propan-2-ylbenzene;1-methyl-3-(trifluoromethoxy)benzene;1-methyl-3-(trifluoromethyl)benzene;4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]morpholine;1-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]piperazine;3-methyl-5-(trifluoromethyl)pyridine;N,N,3-trimethyl-5-(trifluoromethyl)aniline.
What is the SMILES notation for N,N-dimethyl-1-[(4-methylphenyl)methyl]pyrrolidin-3-amine;N,N-dimethyl-1-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]pyrrolidin-3-amine;1-methyl-4-[(4-methylphenyl)methyl]piperazine;4-methyl-1-[3-methyl-5-(trifluoromethyl)phenyl]imidazole;1-methyl-4-[[3-methyl-5-(trifluoromethyl)phenyl]methyl]piperazine;1-methyl-4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]piperazine;1-methyl-4-[3-methyl-5-(trifluoromethyl)phenyl]piperazine;1-methyl-3-propan-2-ylbenzene;1-methyl-3-(trifluoromethoxy)benzene;1-methyl-3-(trifluoromethyl)benzene;4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]morpholine;1-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]piperazine;3-methyl-5-(trifluoromethyl)pyridine;N,N,3-trimethyl-5-(trifluoromethyl)aniline?
The canonical SMILES for N,N-dimethyl-1-[(4-methylphenyl)methyl]pyrrolidin-3-amine;N,N-dimethyl-1-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]pyrrolidin-3-amine;1-methyl-4-[(4-methylphenyl)methyl]piperazine;4-methyl-1-[3-methyl-5-(trifluoromethyl)phenyl]imidazole;1-methyl-4-[[3-methyl-5-(trifluoromethyl)phenyl]methyl]piperazine;1-methyl-4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]piperazine;1-methyl-4-[3-methyl-5-(trifluoromethyl)phenyl]piperazine;1-methyl-3-propan-2-ylbenzene;1-methyl-3-(trifluoromethoxy)benzene;1-methyl-3-(trifluoromethyl)benzene;4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]morpholine;1-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]piperazine;3-methyl-5-(trifluoromethyl)pyridine;N,N,3-trimethyl-5-(trifluoromethyl)aniline is Cc1cc(-n2cnc(C)c2)cc(C(F)(F)F)c1.Cc1cc(CN2CCN(C)CC2)cc(C(F)(F)F)c1.Cc1cc(N(C)C)cc(C(F)(F)F)c1.Cc1cc(N2CCN(C)CC2)cc(C(F)(F)F)c1.Cc1ccc(CN2CCC(N(C)C)C2)c(C(F)(F)F)c1.Cc1ccc(CN2CCC(N(C)C)C2)cc1.Cc1ccc(CN2CCN(C)CC2)c(C(F)(F)F)c1.Cc1ccc(CN2CCN(C)CC2)cc1.Cc1ccc(CN2CCNCC2)c(C(F)(F)F)c1.Cc1ccc(CN2CCOCC2)c(C(F)(F)F)c1.Cc1cccc(C(C)C)c1.Cc1cccc(C(F)(F)F)c1.Cc1cccc(OC(F)(F)F)c1.Cc1cncc(C(F)(F)F)c1.
What is the InChIKey of N,N-dimethyl-1-[(4-methylphenyl)methyl]pyrrolidin-3-amine;N,N-dimethyl-1-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]pyrrolidin-3-amine;1-methyl-4-[(4-methylphenyl)methyl]piperazine;4-methyl-1-[3-methyl-5-(trifluoromethyl)phenyl]imidazole;1-methyl-4-[[3-methyl-5-(trifluoromethyl)phenyl]methyl]piperazine;1-methyl-4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]piperazine;1-methyl-4-[3-methyl-5-(trifluoromethyl)phenyl]piperazine;1-methyl-3-propan-2-ylbenzene;1-methyl-3-(trifluoromethoxy)benzene;1-methyl-3-(trifluoromethyl)benzene;4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]morpholine;1-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]piperazine;3-methyl-5-(trifluoromethyl)pyridine;N,N,3-trimethyl-5-(trifluoromethyl)aniline?
The InChIKey is VRXNPFXQXBFUPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21F3N2.2C14H19F3N2.C14H22N2.2C13H17F3N2.C13H16F3NO.C13H20N2.C12H11F3N2.C10H12F3N.C10H14.C8H7F3O.C8H7F3.C7H6F3N/c1-11-4-5-12(14(8-11)15(16,17)18)9-20-7-6-13(10-20)19(2)3;1-11-7-12(9-13(8-11)14(15,16)17)10-19-5-3-18(2)4-6-19;1-11-3-4-12(13(9-11)14(15,16)17)10-19-7-5-18(2)6-8-19;1-12-4-6-13(7-5-12)10-16-9-8-14(11-16)15(2)3;1-10-7-11(13(14,15)16)9-12(8-10)18-5-3-17(2)4-6-18;1-10-2-3-11(12(8-10)13(14,15)16)9-18-6-4-17-5-7-18;1-10-2-3-11(12(8-10)13(14,15)16)9-17-4-6-18-7-5-17;1-12-3-5-13(6-4-12)11-15-9-7-14(2)8-10-15;1-8-3-10(12(13,14)15)5-11(4-8)17-6-9(2)16-7-17;1-7-4-8(10(11,12)13)6-9(5-7)14(2)3;1-8(2)10-6-4-5-9(3)7-10;1-6-3-2-4-7(5-6)12-8(9,10)11;1-6-3-2-4-7(5-6)8(9,10)11;1-5-2-6(4-11-3-5)7(8,9)10/h4-5,8,13H,6-7,9-10H2,1-3H3;7-9H,3-6,10H2,1-2H3;3-4,9H,5-8,10H2,1-2H3;4-7,14H,8-11H2,1-3H3;7-9H,3-6H2,1-2H3;2-3,8,17H,4-7,9H2,1H3;2-3,8H,4-7,9H2,1H3;3-6H,7-11H2,1-2H3;3-7H,1-2H3;4-6H,1-3H3;4-8H,1-3H3;2-5H,1H3;2-5H,1H3;2-4H,1H3.
What are the key properties of N,N-dimethyl-1-[(4-methylphenyl)methyl]pyrrolidin-3-amine;N,N-dimethyl-1-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]pyrrolidin-3-amine;1-methyl-4-[(4-methylphenyl)methyl]piperazine;4-methyl-1-[3-methyl-5-(trifluoromethyl)phenyl]imidazole;1-methyl-4-[[3-methyl-5-(trifluoromethyl)phenyl]methyl]piperazine;1-methyl-4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]piperazine;1-methyl-4-[3-methyl-5-(trifluoromethyl)phenyl]piperazine;1-methyl-3-propan-2-ylbenzene;1-methyl-3-(trifluoromethoxy)benzene;1-methyl-3-(trifluoromethyl)benzene;4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]morpholine;1-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]piperazine;3-methyl-5-(trifluoromethyl)pyridine;N,N,3-trimethyl-5-(trifluoromethyl)aniline?
N,N-dimethyl-1-[(4-methylphenyl)methyl]pyrrolidin-3-amine;N,N-dimethyl-1-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]pyrrolidin-3-amine;1-methyl-4-[(4-methylphenyl)methyl]piperazine;4-methyl-1-[3-methyl-5-(trifluoromethyl)phenyl]imidazole;1-methyl-4-[[3-methyl-5-(trifluoromethyl)phenyl]methyl]piperazine;1-methyl-4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]piperazine;1-methyl-4-[3-methyl-5-(trifluoromethyl)phenyl]piperazine;1-methyl-3-propan-2-ylbenzene;1-methyl-3-(trifluoromethoxy)benzene;1-methyl-3-(trifluoromethyl)benzene;4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]morpholine;1-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]piperazine;3-methyl-5-(trifluoromethyl)pyridine;N,N,3-trimethyl-5-(trifluoromethyl)aniline has a molecular weight of 3104.53 g/mol, XLogP of 38.60, 21 rotatable bonds, 1 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-[(4-methylphenyl)methyl]pyrrolidin-3-amine;N,N-dimethyl-1-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]pyrrolidin-3-amine;1-methyl-4-[(4-methylphenyl)methyl]piperazine;4-methyl-1-[3-methyl-5-(trifluoromethyl)phenyl]imidazole;1-methyl-4-[[3-methyl-5-(trifluoromethyl)phenyl]methyl]piperazine;1-methyl-4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]piperazine;1-methyl-4-[3-methyl-5-(trifluoromethyl)phenyl]piperazine;1-methyl-3-propan-2-ylbenzene;1-methyl-3-(trifluoromethoxy)benzene;1-methyl-3-(trifluoromethyl)benzene;4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]morpholine;1-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]piperazine;3-methyl-5-(trifluoromethyl)pyridine;N,N,3-trimethyl-5-(trifluoromethyl)aniline is sourced from PubChem (CID 161382636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).