2-(azetidin-1-yl)-4-propan-2-ylpyridine;5-chloro-1-methyl-4-propan-2-yl-3-(trifluoromethyl)pyrazole;4-methyl-2-phenyl-5-propan-2-yl-1,3-thiazole;4-methyl-7-propan-2-yl-2,3-dihydro-1,4-benzoxazine;4-methyl-7-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazine;2-methyl-3-propan-2-ylpyridine;2-methyl-4-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;1-phenyl-5-propan-2-ylpyrazole;3-propan-2-ylpyridine;bis(4-(4-propan-2-yl-2-pyridinyl)morpholine);4-propan-2-yl-2-pyrrolidin-1-ylpyridine

C147H205ClF3N21O4S — CID 160672272

IUPAC2-(azetidin-1-yl)-4-propan-2-ylpyridine;5-chloro-1-methyl-4-propan-2-yl-3-(trifluoromethyl)pyrazole;4-methyl-2-phenyl-5-propan-2-yl-1,3-thiazole;4-methyl-7-propan-2-yl-2,3-dihydro-1,4-benzoxazine;4-methyl-7-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazine;2-methyl-3-propan-2-ylpyridine;2-methyl-4-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;1-phenyl-5-propan-2-ylpyrazole;3-propan-2-ylpyridine;bis(4-(4-propan-2-yl-2-pyridinyl)morpholine);4-propan-2-yl-2-pyrrolidin-1-ylpyridine
SMILESCC(C)c1c(C(F)(F)F)nn(C)c1Cl.CC(C)c1ccc2c(c1)OCCN2C.CC(C)c1cccnc1.CC(C)c1ccnc(N2CCC2)c1.CC(C)c1ccnc(N2CCCC2)c1.CC(C)c1ccnc(N2CCOCC2)c1.CC(C)c1ccnc(N2CCOCC2)c1.CC(C)c1ccnn1-c1ccccc1.CC(C)c1cnc2c(c1)OCCN2C.Cc1cc(C(C)C)ccn1.Cc1ccc(C(C)C)cn1.Cc1cncc(C(C)C)c1.Cc1nc(-c2ccccc2)sc1C(C)C.Cc1ncccc1C(C)C
InChIInChI=1S/C13H15NS.2C12H18N2O.C12H18N2.C12H14N2.C12H17NO.C11H16N2O.C11H16N2.4C9H13N.C8H10ClF3N2.C8H11N/c1-9(2)12-10(3)14-13(15-12)11-7-5-4-6-8-11;2*1-10(2)11-3-4-13-12(9-11)14-5-7-15-8-6-14;1-10(2)11-5-6-13-12(9-11)14-7-3-4-8-14;1-10(2)12-8-9-13-14(12)11-6-4-3-5-7-11;1-9(2)10-4-5-11-12(8-10)14-7-6-13(11)3;1-8(2)9-6-10-11(12-7-9)13(3)4-5-14-10;1-9(2)10-4-5-12-11(8-10)13-6-3-7-13;1-7(2)9-4-8(3)5-10-6-9;1-7(2)9-4-5-10-8(3)6-9;1-7(2)9-5-4-8(3)10-6-9;1-7(2)9-5-4-6-10-8(9)3;1-4(2)5-6(8(10,11)12)13-14(3)7(5)9;1-7(2)8-4-3-5-9-6-8/h4-9H,1-3H3;2*3-4,9-10H,5-8H2,1-2H3;5-6,9-10H,3-4,7-8H2,1-2H3;3-10H,1-2H3;4-5,8-9H,6-7H2,1-3H3;6-8H,4-5H2,1-3H3;4-5,8-9H,3,6-7H2,1-2H3;4*4-7H,1-3H3;4H,1-3H3;3-7H,1-2H3
InChIKeyRNBQDLCSZUKNBH-UHFFFAOYSA-N
MW2454.91 g/mol
LogP36.69
Rot. Bonds20

About 2-(azetidin-1-yl)-4-propan-2-ylpyridine;5-chloro-1-methyl-4-propan-2-yl-3-(trifluoromethyl)pyrazole;4-methyl-2-phenyl-5-propan-2-yl-1,3-thiazole;4-methyl-7-propan-2-yl-2,3-dihydro-1,4-benzoxazine;4-methyl-7-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazine;2-methyl-3-propan-2-ylpyridine;2-methyl-4-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;1-phenyl-5-propan-2-ylpyrazole;3-propan-2-ylpyridine;bis(4-(4-propan-2-yl-2-pyridinyl)morpholine);4-propan-2-yl-2-pyrrolidin-1-ylpyridine

2-(azetidin-1-yl)-4-propan-2-ylpyridine;5-chloro-1-methyl-4-propan-2-yl-3-(trifluoromethyl)pyrazole;4-methyl-2-phenyl-5-propan-2-yl-1,3-thiazole;4-methyl-7-propan-2-yl-2,3-dihydro-1,4-benzoxazine;4-methyl-7-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazine;2-methyl-3-propan-2-ylpyridine;2-methyl-4-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;1-phenyl-5-propan-2-ylpyrazole;3-propan-2-ylpyridine;bis(4-(4-propan-2-yl-2-pyridinyl)morpholine);4-propan-2-yl-2-pyrrolidin-1-ylpyridine (PubChem CID 160672272) has the molecular formula C147H205ClF3N21O4S and a molecular weight of 2454.91 g/mol. Its IUPAC name is 2-(azetidin-1-yl)-4-propan-2-ylpyridine;5-chloro-1-methyl-4-propan-2-yl-3-(trifluoromethyl)pyrazole;4-methyl-2-phenyl-5-propan-2-yl-1,3-thiazole;4-methyl-7-propan-2-yl-2,3-dihydro-1,4-benzoxazine;4-methyl-7-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazine;2-methyl-3-propan-2-ylpyridine;2-methyl-4-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;1-phenyl-5-propan-2-ylpyrazole;3-propan-2-ylpyridine;bis(4-(4-propan-2-yl-2-pyridinyl)morpholine);4-propan-2-yl-2-pyrrolidin-1-ylpyridine.

Molecular Properties

Compound Name2-(azetidin-1-yl)-4-propan-2-ylpyridine;5-chloro-1-methyl-4-propan-2-yl-3-(trifluoromethyl)pyrazole;4-methyl-2-phenyl-5-propan-2-yl-1,3-thiazole;4-methyl-7-propan-2-yl-2,3-dihydro-1,4-benzoxazine;4-methyl-7-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazine;2-methyl-3-propan-2-ylpyridine;2-methyl-4-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;1-phenyl-5-propan-2-ylpyrazole;3-propan-2-ylpyridine;bis(4-(4-propan-2-yl-2-pyridinyl)morpholine);4-propan-2-yl-2-pyrrolidin-1-ylpyridine
PubChem CID160672272
Molecular FormulaC147H205ClF3N21O4S
Molecular Weight2454.91 g/mol
Exact Mass2452.58
IUPAC Name2-(azetidin-1-yl)-4-propan-2-ylpyridine;5-chloro-1-methyl-4-propan-2-yl-3-(trifluoromethyl)pyrazole;4-methyl-2-phenyl-5-propan-2-yl-1,3-thiazole;4-methyl-7-propan-2-yl-2,3-dihydro-1,4-benzoxazine;4-methyl-7-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazine;2-methyl-3-propan-2-ylpyridine;2-methyl-4-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;1-phenyl-5-propan-2-ylpyrazole;3-propan-2-ylpyridine;bis(4-(4-propan-2-yl-2-pyridinyl)morpholine);4-propan-2-yl-2-pyrrolidin-1-ylpyridine
SMILESCC(C)c1c(C(F)(F)F)nn(C)c1Cl.CC(C)c1ccc2c(c1)OCCN2C.CC(C)c1cccnc1.CC(C)c1ccnc(N2CCC2)c1.CC(C)c1ccnc(N2CCCC2)c1.CC(C)c1ccnc(N2CCOCC2)c1.CC(C)c1ccnc(N2CCOCC2)c1.CC(C)c1ccnn1-c1ccccc1.CC(C)c1cnc2c(c1)OCCN2C.Cc1cc(C(C)C)ccn1.Cc1ccc(C(C)C)cn1.Cc1cncc(C(C)C)c1.Cc1nc(-c2ccccc2)sc1C(C)C.Cc1ncccc1C(C)C
InChIInChI=1S/C13H15NS.2C12H18N2O.C12H18N2.C12H14N2.C12H17NO.C11H16N2O.C11H16N2.4C9H13N.C8H10ClF3N2.C8H11N/c1-9(2)12-10(3)14-13(15-12)11-7-5-4-6-8-11;2*1-10(2)11-3-4-13-12(9-11)14-5-7-15-8-6-14;1-10(2)11-5-6-13-12(9-11)14-7-3-4-8-14;1-10(2)12-8-9-13-14(12)11-6-4-3-5-7-11;1-9(2)10-4-5-11-12(8-10)14-7-6-13(11)3;1-8(2)9-6-10-11(12-7-9)13(3)4-5-14-10;1-9(2)10-4-5-12-11(8-10)13-6-3-7-13;1-7(2)9-4-8(3)5-10-6-9;1-7(2)9-4-5-10-8(3)6-9;1-7(2)9-5-4-8(3)10-6-9;1-7(2)9-5-4-6-10-8(9)3;1-4(2)5-6(8(10,11)12)13-14(3)7(5)9;1-7(2)8-4-3-5-9-6-8/h4-9H,1-3H3;2*3-4,9-10H,5-8H2,1-2H3;5-6,9-10H,3-4,7-8H2,1-2H3;3-10H,1-2H3;4-5,8-9H,6-7H2,1-3H3;6-8H,4-5H2,1-3H3;4-5,8-9H,3,6-7H2,1-2H3;4*4-7H,1-3H3;4H,1-3H3;3-7H,1-2H3
InChIKeyRNBQDLCSZUKNBH-UHFFFAOYSA-N
XLogP36.69
TPSA233.79 Ų
H-Bond Donors
H-Bond Acceptors26
Rotatable Bonds20
Heavy Atoms177
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002454.91
LogP ≤ 536.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1026

Analyze 2-(azetidin-1-yl)-4-propan-2-ylpyridine;5-chloro-1-methyl-4-propan-2-yl-3-(trifluoromethyl)pyrazole;4-methyl-2-phenyl-5-propan-2-yl-1,3-thiazole;4-methyl-7-propan-2-yl-2,3-dihydro-1,4-benzoxazine;4-methyl-7-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazine;2-methyl-3-propan-2-ylpyridine;2-methyl-4-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;1-phenyl-5-propan-2-ylpyrazole;3-propan-2-ylpyridine;bis(4-(4-propan-2-yl-2-pyridinyl)morpholine);4-propan-2-yl-2-pyrrolidin-1-ylpyridine with MolForge

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Launch Full Analysis

Related Compounds

2-(Azetidin-1-yl)-4-propan-2-ylpyridine;5-chloro-1-methyl-4-propan-2-yl-3-(trifluoromethyl)pyrazole;cumene;methane;1-methyl-4-propan-2-ylbenzene;4-methyl-7-propan-2-yl-2,3-dihydro-1,4-benzoxazine;4-methyl-7-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazine;1-phenyl-2-propan-2-ylpyrrole;2-piperidin-1-yl-4-propan-2-ylpyridine;4-(4-propan-2-yl-2-pyridinyl)morpholine;4-propan-2-yl-2-pyrrolidin-1-ylpyridine
CID 157414372
2-(azetidin-1-yl)-4-propan-2-ylpyridine;5-chloro-1-methyl-4-propan-2-yl-3-(trifluoromethyl)pyrazole;cumene;2,2-difluoro-4-propan-2-yl-1,3-benzodioxole;2,4-dimethyl-5-propan-2-yl-1,3-thiazole;methane;2-methyl-4-phenyl-5-propan-2-yl-1,3-thiazole;4-methyl-2-phenyl-5-propan-2-yl-1,3-thiazole;4-methyl-2-piperidin-1-yl-5-propan-2-yl-1,3-thiazole;1-methyl-2-propan-2-ylbenzene;4-methyl-7-propan-2-yl-2,3-dihydro-1,4-benzoxazine;4-methyl-7-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazine;2-methyl-4-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;1-phenyl-2-propan-2-ylpyrrole;2-piperidin-1-yl-4-propan-2-ylpyridine;5-(3-propan-2-ylphenyl)-1H-1,2,4-triazole;4-(4-propan-2-yl-2-pyridinyl)morpholine;4-propan-2-yl-2-pyrrolidin-1-ylpyridine
CID 159520725
Cumene;2,4-dimethyl-5-propan-2-yl-1,3-thiazole;methane;4-methyl-2-piperidin-1-yl-5-propan-2-yl-1,3-thiazole;1-methyl-2-propan-2-ylbenzene;bis(1-methyl-3-propan-2-ylbenzene);4-methyl-7-propan-2-yl-2,3-dihydro-1,4-benzoxazine;4-methyl-7-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazine;2-methyl-5-propan-2-ylpyridine;4-(4-propan-2-yl-2-pyridinyl)morpholine;1-propan-2-yl-2-(trifluoromethyl)benzene;3-propan-2-yl-4-(trifluoromethyl)pyridine
CID 161399309
2-(Azetidin-1-yl)-4-propan-2-ylpyridine;5-chloro-1-methyl-4-propan-2-yl-3-(trifluoromethyl)pyrazole;methane;4-methyl-7-propan-2-yl-2,3-dihydro-1,4-benzoxazine;4-methyl-7-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazine;1-phenyl-2-propan-2-ylpyrrole;2-piperidin-1-yl-4-propan-2-ylpyridine;4-(4-propan-2-yl-2-pyridinyl)morpholine;4-propan-2-yl-2-pyrrolidin-1-ylpyridine
CID 161600200
2,4-Dimethyl-5-propan-2-yl-1,3-thiazole;4-methyl-2-piperidin-1-yl-5-propan-2-yl-1,3-thiazole;1-methyl-3-propan-2-ylbenzene;4-methyl-7-propan-2-yl-2,3-dihydro-1,4-benzoxazine;4-methyl-7-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazine;4-(4-propan-2-yl-2-pyridinyl)morpholine
CID 157634528
Cumene;2,4-dimethyl-5-propan-2-yl-1,3-thiazole;methane;4-methyl-2-piperidin-1-yl-5-propan-2-yl-1,3-thiazole;1-methyl-2-propan-2-ylbenzene;1-methyl-3-propan-2-ylbenzene;4-methyl-7-propan-2-yl-2,3-dihydro-1,4-benzoxazine;4-methyl-7-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazine;2-methyl-5-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;4-(4-propan-2-yl-2-pyridinyl)morpholine
CID 158235826
4-[2-(5-chloro-3-pyridinyl)ethynyl]-2-methyl-1,3-thiazole;4-[2-[6-(2-ethoxyphenyl)-3-pyridinyl]ethynyl]-2-methyl-1,3-thiazole;4-[2-[6-(4-fluoropiperidin-1-yl)-3-pyridinyl]ethynyl]-2-methyl-1,3-thiazole;N-methyl-5-[2-(2-methyl-1,3-thiazol-4-yl)ethynyl]-N-propylpyridin-2-amine;2-methyl-4-[2-[6-(3-pyrazol-1-ylphenyl)-3-pyridinyl]ethynyl]-1,3-thiazole;2-methyl-4-[2-(5-pyridin-3-yloxy-3-pyridinyl)ethynyl]-1,3-thiazole
CID 159052120
2,4-Dimethyl-5-propan-2-yl-1,3-thiazole;4-methyl-2-piperidin-1-yl-5-propan-2-yl-1,3-thiazole;4-methyl-7-propan-2-yl-2,3-dihydro-1,4-benzoxazine;4-methyl-7-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazine;3-methyl-5-propan-2-ylpyridine;4-(4-propan-2-yl-2-pyridinyl)morpholine
CID 159849006
3,5-Dimethyl-4-propan-2-yl-1,2-oxazole;1,3-dimethyl-5-propan-2-ylpyrazole;1,5-dimethyl-4-propan-2-ylpyrazole;2,4-dimethyl-5-propan-2-yl-1,3-thiazole;4-methyl-7-propan-2-yl-2,3-dihydro-1,4-benzoxazine;4-methyl-7-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazine;1-methyl-5-propan-2-ylpyrazole;4-(4-methyl-5-propan-2-yl-1,3-thiazol-2-yl)morpholine;4-(4-propan-2-yl-2-pyridinyl)morpholine
CID 160056252
3,5-Dimethyl-4-propan-2-yl-1,2-oxazole;1,3-dimethyl-5-propan-2-ylpyrazole;1,5-dimethyl-4-propan-2-ylpyrazole;2,4-dimethyl-5-propan-2-yl-1,3-thiazole;4-methyl-2-piperidin-1-yl-5-propan-2-yl-1,3-thiazole;1-methyl-3-propan-2-ylbenzene;4-methyl-7-propan-2-yl-2,3-dihydro-1,4-benzoxazine;4-methyl-7-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazine;1-methyl-5-propan-2-ylpyrazole;3-methyl-5-propan-2-ylpyridine;4-(4-propan-2-yl-2-pyridinyl)morpholine
CID 161566263
9-Chloro-3-(cyclopropylmethyl)-5,10,16,19-tetramethyl-20-oxa-3,4,10,11,23-pentazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2(6),4,8,11,13(18),14,16,21,23-decaen-22-amine;3-(cyclopropylmethyl)-10-(difluoromethyl)-16-methyl-20-oxa-3,4,11,12,23-pentazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2(6),4,8,10,13(18),14,16,21,23-decaen-22-amine;3-(difluoromethyl)-10,16,19-trimethyl-20-oxa-9-thia-3,4,11,23-tetrazapentacyclo[19.3.1.02,6.08,12.013,18]pentacosa-1(25),2(6),4,8(12),10,13(18),14,16,21,23-decaen-22-amine
CID 165109816

Frequently Asked Questions

What is the IUPAC name of 2-(azetidin-1-yl)-4-propan-2-ylpyridine;5-chloro-1-methyl-4-propan-2-yl-3-(trifluoromethyl)pyrazole;4-methyl-2-phenyl-5-propan-2-yl-1,3-thiazole;4-methyl-7-propan-2-yl-2,3-dihydro-1,4-benzoxazine;4-methyl-7-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazine;2-methyl-3-propan-2-ylpyridine;2-methyl-4-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;1-phenyl-5-propan-2-ylpyrazole;3-propan-2-ylpyridine;bis(4-(4-propan-2-yl-2-pyridinyl)morpholine);4-propan-2-yl-2-pyrrolidin-1-ylpyridine?
The IUPAC name of 2-(azetidin-1-yl)-4-propan-2-ylpyridine;5-chloro-1-methyl-4-propan-2-yl-3-(trifluoromethyl)pyrazole;4-methyl-2-phenyl-5-propan-2-yl-1,3-thiazole;4-methyl-7-propan-2-yl-2,3-dihydro-1,4-benzoxazine;4-methyl-7-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazine;2-methyl-3-propan-2-ylpyridine;2-methyl-4-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;1-phenyl-5-propan-2-ylpyrazole;3-propan-2-ylpyridine;bis(4-(4-propan-2-yl-2-pyridinyl)morpholine);4-propan-2-yl-2-pyrrolidin-1-ylpyridine (CID 160672272) is 2-(azetidin-1-yl)-4-propan-2-ylpyridine;5-chloro-1-methyl-4-propan-2-yl-3-(trifluoromethyl)pyrazole;4-methyl-2-phenyl-5-propan-2-yl-1,3-thiazole;4-methyl-7-propan-2-yl-2,3-dihydro-1,4-benzoxazine;4-methyl-7-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazine;2-methyl-3-propan-2-ylpyridine;2-methyl-4-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;1-phenyl-5-propan-2-ylpyrazole;3-propan-2-ylpyridine;bis(4-(4-propan-2-yl-2-pyridinyl)morpholine);4-propan-2-yl-2-pyrrolidin-1-ylpyridine.
What is the SMILES notation for 2-(azetidin-1-yl)-4-propan-2-ylpyridine;5-chloro-1-methyl-4-propan-2-yl-3-(trifluoromethyl)pyrazole;4-methyl-2-phenyl-5-propan-2-yl-1,3-thiazole;4-methyl-7-propan-2-yl-2,3-dihydro-1,4-benzoxazine;4-methyl-7-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazine;2-methyl-3-propan-2-ylpyridine;2-methyl-4-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;1-phenyl-5-propan-2-ylpyrazole;3-propan-2-ylpyridine;bis(4-(4-propan-2-yl-2-pyridinyl)morpholine);4-propan-2-yl-2-pyrrolidin-1-ylpyridine?
The canonical SMILES for 2-(azetidin-1-yl)-4-propan-2-ylpyridine;5-chloro-1-methyl-4-propan-2-yl-3-(trifluoromethyl)pyrazole;4-methyl-2-phenyl-5-propan-2-yl-1,3-thiazole;4-methyl-7-propan-2-yl-2,3-dihydro-1,4-benzoxazine;4-methyl-7-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazine;2-methyl-3-propan-2-ylpyridine;2-methyl-4-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;1-phenyl-5-propan-2-ylpyrazole;3-propan-2-ylpyridine;bis(4-(4-propan-2-yl-2-pyridinyl)morpholine);4-propan-2-yl-2-pyrrolidin-1-ylpyridine is CC(C)c1c(C(F)(F)F)nn(C)c1Cl.CC(C)c1ccc2c(c1)OCCN2C.CC(C)c1cccnc1.CC(C)c1ccnc(N2CCC2)c1.CC(C)c1ccnc(N2CCCC2)c1.CC(C)c1ccnc(N2CCOCC2)c1.CC(C)c1ccnc(N2CCOCC2)c1.CC(C)c1ccnn1-c1ccccc1.CC(C)c1cnc2c(c1)OCCN2C.Cc1cc(C(C)C)ccn1.Cc1ccc(C(C)C)cn1.Cc1cncc(C(C)C)c1.Cc1nc(-c2ccccc2)sc1C(C)C.Cc1ncccc1C(C)C.
What is the InChIKey of 2-(azetidin-1-yl)-4-propan-2-ylpyridine;5-chloro-1-methyl-4-propan-2-yl-3-(trifluoromethyl)pyrazole;4-methyl-2-phenyl-5-propan-2-yl-1,3-thiazole;4-methyl-7-propan-2-yl-2,3-dihydro-1,4-benzoxazine;4-methyl-7-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazine;2-methyl-3-propan-2-ylpyridine;2-methyl-4-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;1-phenyl-5-propan-2-ylpyrazole;3-propan-2-ylpyridine;bis(4-(4-propan-2-yl-2-pyridinyl)morpholine);4-propan-2-yl-2-pyrrolidin-1-ylpyridine?
The InChIKey is RNBQDLCSZUKNBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NS.2C12H18N2O.C12H18N2.C12H14N2.C12H17NO.C11H16N2O.C11H16N2.4C9H13N.C8H10ClF3N2.C8H11N/c1-9(2)12-10(3)14-13(15-12)11-7-5-4-6-8-11;2*1-10(2)11-3-4-13-12(9-11)14-5-7-15-8-6-14;1-10(2)11-5-6-13-12(9-11)14-7-3-4-8-14;1-10(2)12-8-9-13-14(12)11-6-4-3-5-7-11;1-9(2)10-4-5-11-12(8-10)14-7-6-13(11)3;1-8(2)9-6-10-11(12-7-9)13(3)4-5-14-10;1-9(2)10-4-5-12-11(8-10)13-6-3-7-13;1-7(2)9-4-8(3)5-10-6-9;1-7(2)9-4-5-10-8(3)6-9;1-7(2)9-5-4-8(3)10-6-9;1-7(2)9-5-4-6-10-8(9)3;1-4(2)5-6(8(10,11)12)13-14(3)7(5)9;1-7(2)8-4-3-5-9-6-8/h4-9H,1-3H3;2*3-4,9-10H,5-8H2,1-2H3;5-6,9-10H,3-4,7-8H2,1-2H3;3-10H,1-2H3;4-5,8-9H,6-7H2,1-3H3;6-8H,4-5H2,1-3H3;4-5,8-9H,3,6-7H2,1-2H3;4*4-7H,1-3H3;4H,1-3H3;3-7H,1-2H3.
What are the key properties of 2-(azetidin-1-yl)-4-propan-2-ylpyridine;5-chloro-1-methyl-4-propan-2-yl-3-(trifluoromethyl)pyrazole;4-methyl-2-phenyl-5-propan-2-yl-1,3-thiazole;4-methyl-7-propan-2-yl-2,3-dihydro-1,4-benzoxazine;4-methyl-7-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazine;2-methyl-3-propan-2-ylpyridine;2-methyl-4-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;1-phenyl-5-propan-2-ylpyrazole;3-propan-2-ylpyridine;bis(4-(4-propan-2-yl-2-pyridinyl)morpholine);4-propan-2-yl-2-pyrrolidin-1-ylpyridine?
2-(azetidin-1-yl)-4-propan-2-ylpyridine;5-chloro-1-methyl-4-propan-2-yl-3-(trifluoromethyl)pyrazole;4-methyl-2-phenyl-5-propan-2-yl-1,3-thiazole;4-methyl-7-propan-2-yl-2,3-dihydro-1,4-benzoxazine;4-methyl-7-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazine;2-methyl-3-propan-2-ylpyridine;2-methyl-4-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;1-phenyl-5-propan-2-ylpyrazole;3-propan-2-ylpyridine;bis(4-(4-propan-2-yl-2-pyridinyl)morpholine);4-propan-2-yl-2-pyrrolidin-1-ylpyridine has a molecular weight of 2454.91 g/mol, XLogP of 36.69, 20 rotatable bonds, 0 hydrogen bond donors, and 26 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(azetidin-1-yl)-4-propan-2-ylpyridine;5-chloro-1-methyl-4-propan-2-yl-3-(trifluoromethyl)pyrazole;4-methyl-2-phenyl-5-propan-2-yl-1,3-thiazole;4-methyl-7-propan-2-yl-2,3-dihydro-1,4-benzoxazine;4-methyl-7-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazine;2-methyl-3-propan-2-ylpyridine;2-methyl-4-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;1-phenyl-5-propan-2-ylpyrazole;3-propan-2-ylpyridine;bis(4-(4-propan-2-yl-2-pyridinyl)morpholine);4-propan-2-yl-2-pyrrolidin-1-ylpyridine is sourced from PubChem (CID 160672272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).