4-chloro-6-propan-2-ylpyrimidine;N,N-dimethyl-4-propan-2-ylpyrimidin-2-amine;N,N-dimethyl-6-propan-2-ylpyrimidin-4-amine;2,4-dimethyl-6-propan-2-ylpyrimidine;4-(4-methylpiperazin-1-yl)-6-propan-2-ylpyrimidine;bis(2-methyl-5-propan-2-ylpyrazine);2-methyl-4-propan-2-ylpyrimidine;2-[4-(2-methyl-6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol;2-[4-(4-methyl-6-propan-2-ylpyrimidin-2-yl)piperazin-1-yl]ethanol;5-propan-2-ylpyrazin-2-amine;2-propan-2-ylpyrazine;2-[4-(5-propan-2-ylpyrazin-2-yl)piperazin-1-yl]ethanol;3-propan-2-ylpyridazine;2-propan-2-ylpyrimidine;2-[(6-propan-2-ylpyrimidin-4-yl)amino]ethanol;4-(6-propan-2-ylpyrimidin-4-yl)morpholine;2-[4-(6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol

C172H274ClN51O6 — CID 157069786

IUPAC4-chloro-6-propan-2-ylpyrimidine;N,N-dimethyl-4-propan-2-ylpyrimidin-2-amine;N,N-dimethyl-6-propan-2-ylpyrimidin-4-amine;2,4-dimethyl-6-propan-2-ylpyrimidine;4-(4-methylpiperazin-1-yl)-6-propan-2-ylpyrimidine;bis(2-methyl-5-propan-2-ylpyrazine);2-methyl-4-propan-2-ylpyrimidine;2-[4-(2-methyl-6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol;2-[4-(4-methyl-6-propan-2-ylpyrimidin-2-yl)piperazin-1-yl]ethanol;5-propan-2-ylpyrazin-2-amine;2-propan-2-ylpyrazine;2-[4-(5-propan-2-ylpyrazin-2-yl)piperazin-1-yl]ethanol;3-propan-2-ylpyridazine;2-propan-2-ylpyrimidine;2-[(6-propan-2-ylpyrimidin-4-yl)amino]ethanol;4-(6-propan-2-ylpyrimidin-4-yl)morpholine;2-[4-(6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol
SMILESCC(C)c1cc(Cl)ncn1.CC(C)c1cc(N(C)C)ncn1.CC(C)c1cc(N2CCN(C)CC2)ncn1.CC(C)c1cc(N2CCN(CCO)CC2)ncn1.CC(C)c1cc(N2CCOCC2)ncn1.CC(C)c1cc(NCCO)ncn1.CC(C)c1cccnn1.CC(C)c1ccnc(N(C)C)n1.CC(C)c1cnc(N)cn1.CC(C)c1cnc(N2CCN(CCO)CC2)cn1.CC(C)c1cnccn1.CC(C)c1ncccn1.Cc1cc(C(C)C)nc(C)n1.Cc1cc(C(C)C)nc(N2CCN(CCO)CC2)n1.Cc1cnc(C(C)C)cn1.Cc1cnc(C(C)C)cn1.Cc1nc(C(C)C)cc(N2CCN(CCO)CC2)n1.Cc1nccc(C(C)C)n1
InChIInChI=1S/2C14H24N4O.2C13H22N4O.C12H20N4.C11H17N3O.C9H15N3O.2C9H15N3.C9H14N2.3C8H12N2.C7H9ClN2.C7H11N3.3C7H10N2/c1-11(2)13-10-14(16-12(3)15-13)18-6-4-17(5-7-18)8-9-19;1-11(2)13-10-12(3)15-14(16-13)18-6-4-17(5-7-18)8-9-19;1-11(2)12-9-15-13(10-14-12)17-5-3-16(4-6-17)7-8-18;1-11(2)12-9-13(15-10-14-12)17-5-3-16(4-6-17)7-8-18;1-10(2)11-8-12(14-9-13-11)16-6-4-15(3)5-7-16;1-9(2)10-7-11(13-8-12-10)14-3-5-15-6-4-14;1-7(2)8-5-9(10-3-4-13)12-6-11-8;1-7(2)8-5-9(12(3)4)11-6-10-8;1-7(2)8-5-6-10-9(11-8)12(3)4;1-6(2)9-5-7(3)10-8(4)11-9;2*1-6(2)8-5-9-7(3)4-10-8;1-6(2)8-4-5-9-7(3)10-8;1-5(2)6-3-7(8)10-4-9-6;1-5(2)6-3-10-7(8)4-9-6;1-6(2)7-5-8-3-4-9-7;1-6(2)7-8-4-3-5-9-7;1-6(2)7-4-3-5-8-9-7/h2*10-11,19H,4-9H2,1-3H3;2*9-11,18H,3-8H2,1-2H3;8-10H,4-7H2,1-3H3;7-9H,3-6H2,1-2H3;5-7,13H,3-4H2,1-2H3,(H,10,11,12);2*5-7H,1-4H3;5-6H,1-4H3;3*4-6H,1-3H3;3-5H,1-2H3;3-5H,1-2H3,(H2,8,10);3*3-6H,1-2H3
InChIKeyACHGMRYCEWCNRU-UHFFFAOYSA-N
MW3187.89 g/mol
LogP26.78
Rot. Bonds37

About 4-chloro-6-propan-2-ylpyrimidine;N,N-dimethyl-4-propan-2-ylpyrimidin-2-amine;N,N-dimethyl-6-propan-2-ylpyrimidin-4-amine;2,4-dimethyl-6-propan-2-ylpyrimidine;4-(4-methylpiperazin-1-yl)-6-propan-2-ylpyrimidine;bis(2-methyl-5-propan-2-ylpyrazine);2-methyl-4-propan-2-ylpyrimidine;2-[4-(2-methyl-6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol;2-[4-(4-methyl-6-propan-2-ylpyrimidin-2-yl)piperazin-1-yl]ethanol;5-propan-2-ylpyrazin-2-amine;2-propan-2-ylpyrazine;2-[4-(5-propan-2-ylpyrazin-2-yl)piperazin-1-yl]ethanol;3-propan-2-ylpyridazine;2-propan-2-ylpyrimidine;2-[(6-propan-2-ylpyrimidin-4-yl)amino]ethanol;4-(6-propan-2-ylpyrimidin-4-yl)morpholine;2-[4-(6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol

4-chloro-6-propan-2-ylpyrimidine;N,N-dimethyl-4-propan-2-ylpyrimidin-2-amine;N,N-dimethyl-6-propan-2-ylpyrimidin-4-amine;2,4-dimethyl-6-propan-2-ylpyrimidine;4-(4-methylpiperazin-1-yl)-6-propan-2-ylpyrimidine;bis(2-methyl-5-propan-2-ylpyrazine);2-methyl-4-propan-2-ylpyrimidine;2-[4-(2-methyl-6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol;2-[4-(4-methyl-6-propan-2-ylpyrimidin-2-yl)piperazin-1-yl]ethanol;5-propan-2-ylpyrazin-2-amine;2-propan-2-ylpyrazine;2-[4-(5-propan-2-ylpyrazin-2-yl)piperazin-1-yl]ethanol;3-propan-2-ylpyridazine;2-propan-2-ylpyrimidine;2-[(6-propan-2-ylpyrimidin-4-yl)amino]ethanol;4-(6-propan-2-ylpyrimidin-4-yl)morpholine;2-[4-(6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol (PubChem CID 157069786) has the molecular formula C172H274ClN51O6 and a molecular weight of 3187.89 g/mol. Its IUPAC name is 4-chloro-6-propan-2-ylpyrimidine;N,N-dimethyl-4-propan-2-ylpyrimidin-2-amine;N,N-dimethyl-6-propan-2-ylpyrimidin-4-amine;2,4-dimethyl-6-propan-2-ylpyrimidine;4-(4-methylpiperazin-1-yl)-6-propan-2-ylpyrimidine;bis(2-methyl-5-propan-2-ylpyrazine);2-methyl-4-propan-2-ylpyrimidine;2-[4-(2-methyl-6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol;2-[4-(4-methyl-6-propan-2-ylpyrimidin-2-yl)piperazin-1-yl]ethanol;5-propan-2-ylpyrazin-2-amine;2-propan-2-ylpyrazine;2-[4-(5-propan-2-ylpyrazin-2-yl)piperazin-1-yl]ethanol;3-propan-2-ylpyridazine;2-propan-2-ylpyrimidine;2-[(6-propan-2-ylpyrimidin-4-yl)amino]ethanol;4-(6-propan-2-ylpyrimidin-4-yl)morpholine;2-[4-(6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol.

Molecular Properties

Compound Name4-chloro-6-propan-2-ylpyrimidine;N,N-dimethyl-4-propan-2-ylpyrimidin-2-amine;N,N-dimethyl-6-propan-2-ylpyrimidin-4-amine;2,4-dimethyl-6-propan-2-ylpyrimidine;4-(4-methylpiperazin-1-yl)-6-propan-2-ylpyrimidine;bis(2-methyl-5-propan-2-ylpyrazine);2-methyl-4-propan-2-ylpyrimidine;2-[4-(2-methyl-6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol;2-[4-(4-methyl-6-propan-2-ylpyrimidin-2-yl)piperazin-1-yl]ethanol;5-propan-2-ylpyrazin-2-amine;2-propan-2-ylpyrazine;2-[4-(5-propan-2-ylpyrazin-2-yl)piperazin-1-yl]ethanol;3-propan-2-ylpyridazine;2-propan-2-ylpyrimidine;2-[(6-propan-2-ylpyrimidin-4-yl)amino]ethanol;4-(6-propan-2-ylpyrimidin-4-yl)morpholine;2-[4-(6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol
PubChem CID157069786
Molecular FormulaC172H274ClN51O6
Molecular Weight3187.89 g/mol
Exact Mass3185.24
IUPAC Name4-chloro-6-propan-2-ylpyrimidine;N,N-dimethyl-4-propan-2-ylpyrimidin-2-amine;N,N-dimethyl-6-propan-2-ylpyrimidin-4-amine;2,4-dimethyl-6-propan-2-ylpyrimidine;4-(4-methylpiperazin-1-yl)-6-propan-2-ylpyrimidine;bis(2-methyl-5-propan-2-ylpyrazine);2-methyl-4-propan-2-ylpyrimidine;2-[4-(2-methyl-6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol;2-[4-(4-methyl-6-propan-2-ylpyrimidin-2-yl)piperazin-1-yl]ethanol;5-propan-2-ylpyrazin-2-amine;2-propan-2-ylpyrazine;2-[4-(5-propan-2-ylpyrazin-2-yl)piperazin-1-yl]ethanol;3-propan-2-ylpyridazine;2-propan-2-ylpyrimidine;2-[(6-propan-2-ylpyrimidin-4-yl)amino]ethanol;4-(6-propan-2-ylpyrimidin-4-yl)morpholine;2-[4-(6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol
SMILESCC(C)c1cc(Cl)ncn1.CC(C)c1cc(N(C)C)ncn1.CC(C)c1cc(N2CCN(C)CC2)ncn1.CC(C)c1cc(N2CCN(CCO)CC2)ncn1.CC(C)c1cc(N2CCOCC2)ncn1.CC(C)c1cc(NCCO)ncn1.CC(C)c1cccnn1.CC(C)c1ccnc(N(C)C)n1.CC(C)c1cnc(N)cn1.CC(C)c1cnc(N2CCN(CCO)CC2)cn1.CC(C)c1cnccn1.CC(C)c1ncccn1.Cc1cc(C(C)C)nc(C)n1.Cc1cc(C(C)C)nc(N2CCN(CCO)CC2)n1.Cc1cnc(C(C)C)cn1.Cc1cnc(C(C)C)cn1.Cc1nc(C(C)C)cc(N2CCN(CCO)CC2)n1.Cc1nccc(C(C)C)n1
InChIInChI=1S/2C14H24N4O.2C13H22N4O.C12H20N4.C11H17N3O.C9H15N3O.2C9H15N3.C9H14N2.3C8H12N2.C7H9ClN2.C7H11N3.3C7H10N2/c1-11(2)13-10-14(16-12(3)15-13)18-6-4-17(5-7-18)8-9-19;1-11(2)13-10-12(3)15-14(16-13)18-6-4-17(5-7-18)8-9-19;1-11(2)12-9-15-13(10-14-12)17-5-3-16(4-6-17)7-8-18;1-11(2)12-9-13(15-10-14-12)17-5-3-16(4-6-17)7-8-18;1-10(2)11-8-12(14-9-13-11)16-6-4-15(3)5-7-16;1-9(2)10-7-11(13-8-12-10)14-3-5-15-6-4-14;1-7(2)8-5-9(10-3-4-13)12-6-11-8;1-7(2)8-5-9(12(3)4)11-6-10-8;1-7(2)8-5-6-10-9(11-8)12(3)4;1-6(2)9-5-7(3)10-8(4)11-9;2*1-6(2)8-5-9-7(3)4-10-8;1-6(2)8-4-5-9-7(3)10-8;1-5(2)6-3-7(8)10-4-9-6;1-5(2)6-3-10-7(8)4-9-6;1-6(2)7-5-8-3-4-9-7;1-6(2)7-8-4-3-5-9-7;1-6(2)7-4-3-5-8-9-7/h2*10-11,19H,4-9H2,1-3H3;2*9-11,18H,3-8H2,1-2H3;8-10H,4-7H2,1-3H3;7-9H,3-6H2,1-2H3;5-7,13H,3-4H2,1-2H3,(H,10,11,12);2*5-7H,1-4H3;5-6H,1-4H3;3*4-6H,1-3H3;3-5H,1-2H3;3-5H,1-2H3,(H2,8,10);3*3-6H,1-2H3
InChIKeyACHGMRYCEWCNRU-UHFFFAOYSA-N
XLogP26.78
TPSA654.59 Ų
H-Bond Donors7
H-Bond Acceptors57
Rotatable Bonds37
Heavy Atoms230
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003187.89
LogP ≤ 526.78
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1057

Analyze 4-chloro-6-propan-2-ylpyrimidine;N,N-dimethyl-4-propan-2-ylpyrimidin-2-amine;N,N-dimethyl-6-propan-2-ylpyrimidin-4-amine;2,4-dimethyl-6-propan-2-ylpyrimidine;4-(4-methylpiperazin-1-yl)-6-propan-2-ylpyrimidine;bis(2-methyl-5-propan-2-ylpyrazine);2-methyl-4-propan-2-ylpyrimidine;2-[4-(2-methyl-6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol;2-[4-(4-methyl-6-propan-2-ylpyrimidin-2-yl)piperazin-1-yl]ethanol;5-propan-2-ylpyrazin-2-amine;2-propan-2-ylpyrazine;2-[4-(5-propan-2-ylpyrazin-2-yl)piperazin-1-yl]ethanol;3-propan-2-ylpyridazine;2-propan-2-ylpyrimidine;2-[(6-propan-2-ylpyrimidin-4-yl)amino]ethanol;4-(6-propan-2-ylpyrimidin-4-yl)morpholine;2-[4-(6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol with MolForge

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Launch Full Analysis

Related Compounds

6-[6-(4-Methylpiperazin-1-yl)-3-pyridinyl]-4-morpholin-4-ylpteridin-2-amine;6-(1-methylpyrazol-4-yl)-4-morpholin-4-ylpteridin-2-amine
CID 69227910
carbonic acid;2-(5-chloro-6-morpholin-4-yl-3-pyridinyl)guanidine;N-(5-chloro-6-morpholin-4-yl-3-pyridinyl)-4-(2-methyl-3-propan-2-ylimidazol-4-yl)pyrimidin-2-amine
CID 69350523
6-chloro-4-N-(4-morpholin-4-ylcyclohexyl)-2-N-[1-(oxan-4-yl)pyrazol-4-yl]pyrido[3,2-d]pyrimidine-2,4-diamine
CID 132184653
2-[4-(6-Chloropyrimidin-4-yl)-3,5-dimethylpyrazol-1-yl]-1-[(5-pyrazin-2-yl-2-pyridinyl)amino]ethanol
CID 139308521
4-[1-(1,8-Naphthyridin-2-yl)-5-piperazin-1-yl-6-piperidin-1-yl-4-pyrazin-2-yl-3-pyridazin-3-yl-2-pyridin-2-yl-2-pyridinyl]morpholine
CID 141135679
4-[(1Z,2E,4Z,6Z)-4-(2,6-dihydro-1H-pyrimidin-3-yl)-6-piperazin-1-yl-7-pyrazin-2-yl-3-pyridazin-3-yl-5-pyrimidin-2-ylazocin-2-yl]morpholine
CID 141170194
2-[4-[3-chloro-5-[[6-[(E)-[(5-methyl-4-morpholin-4-ylpyrimidin-2-yl)hydrazinylidene]methyl]-3-pyridinyl]amino]phenyl]piperazin-1-yl]ethanol
CID 143471116
N-(4-chlorophenyl)-3-[3-[2-[4-[6-[4-[2-[4-[5-(4-methylpiperazin-1-yl)-6-phenylpyridazin-3-yl]piperazin-1-yl]pyrimidin-5-yl]phenyl]-5-morpholin-4-ylpyridazin-3-yl]piperazin-1-yl]pyrimidin-5-yl]phenyl]-6-(4-pyrimidin-2-ylpiperazin-1-yl)pyridazin-4-amine
CID 143572544
4-[2-[[6-Chloro-5-(2,2-dimethylhydrazinyl)-3-pyridinyl]amino]-5-(morpholin-4-ylmethyl)-3-pyridinyl]-6-methyl-1,3,5-triazin-2-amine;ethanol;methanol
CID 144083601
4-[3-[4-(6-chloro-1,5-naphthyridin-3-yl)-3-ethylpyrazol-1-yl]propyl]morpholine;7-[3-ethyl-1-(3-morpholin-4-ylpropyl)pyrazol-4-yl]-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine
CID 157311173
4-chloro-6-propan-2-ylpyrimidine;N,N-dimethyl-4-propan-2-ylpyrimidin-2-amine;2,4-dimethyl-6-propan-2-ylpyrimidine;methane;2-[4-(4-methyl-6-propan-2-ylpyrimidin-2-yl)piperazin-1-yl]ethanol;2-propan-2-ylpyrazine;3-propan-2-ylpyridazine;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;4-(6-propan-2-ylpyrimidin-4-yl)morpholine
CID 157552693
4-chloro-6-propan-2-ylpyrimidine;N,N-dimethyl-4-propan-2-ylpyrimidin-2-amine;N,N-dimethyl-6-propan-2-ylpyrimidin-4-amine;2,4-dimethyl-6-propan-2-ylpyrimidine;4-ethyl-2-propan-2-ylpyridine;2-methyl-4-propan-2-ylpyrimidine;2-[4-(2-methyl-6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol;2-[4-(4-methyl-6-propan-2-ylpyrimidin-2-yl)piperazin-1-yl]ethanol;2-propan-2-ylpyrazine;3-propan-2-ylpyridazine;(2-propan-2-yl-4-pyridinyl)methanol;(6-propan-2-yl-3-pyridinyl)methanol;2-propan-2-ylpyrimidine;4-(6-propan-2-ylpyrimidin-4-yl)morpholine;2-[4-(6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol
CID 157671711

Frequently Asked Questions

What is the IUPAC name of 4-chloro-6-propan-2-ylpyrimidine;N,N-dimethyl-4-propan-2-ylpyrimidin-2-amine;N,N-dimethyl-6-propan-2-ylpyrimidin-4-amine;2,4-dimethyl-6-propan-2-ylpyrimidine;4-(4-methylpiperazin-1-yl)-6-propan-2-ylpyrimidine;bis(2-methyl-5-propan-2-ylpyrazine);2-methyl-4-propan-2-ylpyrimidine;2-[4-(2-methyl-6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol;2-[4-(4-methyl-6-propan-2-ylpyrimidin-2-yl)piperazin-1-yl]ethanol;5-propan-2-ylpyrazin-2-amine;2-propan-2-ylpyrazine;2-[4-(5-propan-2-ylpyrazin-2-yl)piperazin-1-yl]ethanol;3-propan-2-ylpyridazine;2-propan-2-ylpyrimidine;2-[(6-propan-2-ylpyrimidin-4-yl)amino]ethanol;4-(6-propan-2-ylpyrimidin-4-yl)morpholine;2-[4-(6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol?
The IUPAC name of 4-chloro-6-propan-2-ylpyrimidine;N,N-dimethyl-4-propan-2-ylpyrimidin-2-amine;N,N-dimethyl-6-propan-2-ylpyrimidin-4-amine;2,4-dimethyl-6-propan-2-ylpyrimidine;4-(4-methylpiperazin-1-yl)-6-propan-2-ylpyrimidine;bis(2-methyl-5-propan-2-ylpyrazine);2-methyl-4-propan-2-ylpyrimidine;2-[4-(2-methyl-6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol;2-[4-(4-methyl-6-propan-2-ylpyrimidin-2-yl)piperazin-1-yl]ethanol;5-propan-2-ylpyrazin-2-amine;2-propan-2-ylpyrazine;2-[4-(5-propan-2-ylpyrazin-2-yl)piperazin-1-yl]ethanol;3-propan-2-ylpyridazine;2-propan-2-ylpyrimidine;2-[(6-propan-2-ylpyrimidin-4-yl)amino]ethanol;4-(6-propan-2-ylpyrimidin-4-yl)morpholine;2-[4-(6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol (CID 157069786) is 4-chloro-6-propan-2-ylpyrimidine;N,N-dimethyl-4-propan-2-ylpyrimidin-2-amine;N,N-dimethyl-6-propan-2-ylpyrimidin-4-amine;2,4-dimethyl-6-propan-2-ylpyrimidine;4-(4-methylpiperazin-1-yl)-6-propan-2-ylpyrimidine;bis(2-methyl-5-propan-2-ylpyrazine);2-methyl-4-propan-2-ylpyrimidine;2-[4-(2-methyl-6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol;2-[4-(4-methyl-6-propan-2-ylpyrimidin-2-yl)piperazin-1-yl]ethanol;5-propan-2-ylpyrazin-2-amine;2-propan-2-ylpyrazine;2-[4-(5-propan-2-ylpyrazin-2-yl)piperazin-1-yl]ethanol;3-propan-2-ylpyridazine;2-propan-2-ylpyrimidine;2-[(6-propan-2-ylpyrimidin-4-yl)amino]ethanol;4-(6-propan-2-ylpyrimidin-4-yl)morpholine;2-[4-(6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol.
What is the SMILES notation for 4-chloro-6-propan-2-ylpyrimidine;N,N-dimethyl-4-propan-2-ylpyrimidin-2-amine;N,N-dimethyl-6-propan-2-ylpyrimidin-4-amine;2,4-dimethyl-6-propan-2-ylpyrimidine;4-(4-methylpiperazin-1-yl)-6-propan-2-ylpyrimidine;bis(2-methyl-5-propan-2-ylpyrazine);2-methyl-4-propan-2-ylpyrimidine;2-[4-(2-methyl-6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol;2-[4-(4-methyl-6-propan-2-ylpyrimidin-2-yl)piperazin-1-yl]ethanol;5-propan-2-ylpyrazin-2-amine;2-propan-2-ylpyrazine;2-[4-(5-propan-2-ylpyrazin-2-yl)piperazin-1-yl]ethanol;3-propan-2-ylpyridazine;2-propan-2-ylpyrimidine;2-[(6-propan-2-ylpyrimidin-4-yl)amino]ethanol;4-(6-propan-2-ylpyrimidin-4-yl)morpholine;2-[4-(6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol?
The canonical SMILES for 4-chloro-6-propan-2-ylpyrimidine;N,N-dimethyl-4-propan-2-ylpyrimidin-2-amine;N,N-dimethyl-6-propan-2-ylpyrimidin-4-amine;2,4-dimethyl-6-propan-2-ylpyrimidine;4-(4-methylpiperazin-1-yl)-6-propan-2-ylpyrimidine;bis(2-methyl-5-propan-2-ylpyrazine);2-methyl-4-propan-2-ylpyrimidine;2-[4-(2-methyl-6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol;2-[4-(4-methyl-6-propan-2-ylpyrimidin-2-yl)piperazin-1-yl]ethanol;5-propan-2-ylpyrazin-2-amine;2-propan-2-ylpyrazine;2-[4-(5-propan-2-ylpyrazin-2-yl)piperazin-1-yl]ethanol;3-propan-2-ylpyridazine;2-propan-2-ylpyrimidine;2-[(6-propan-2-ylpyrimidin-4-yl)amino]ethanol;4-(6-propan-2-ylpyrimidin-4-yl)morpholine;2-[4-(6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol is CC(C)c1cc(Cl)ncn1.CC(C)c1cc(N(C)C)ncn1.CC(C)c1cc(N2CCN(C)CC2)ncn1.CC(C)c1cc(N2CCN(CCO)CC2)ncn1.CC(C)c1cc(N2CCOCC2)ncn1.CC(C)c1cc(NCCO)ncn1.CC(C)c1cccnn1.CC(C)c1ccnc(N(C)C)n1.CC(C)c1cnc(N)cn1.CC(C)c1cnc(N2CCN(CCO)CC2)cn1.CC(C)c1cnccn1.CC(C)c1ncccn1.Cc1cc(C(C)C)nc(C)n1.Cc1cc(C(C)C)nc(N2CCN(CCO)CC2)n1.Cc1cnc(C(C)C)cn1.Cc1cnc(C(C)C)cn1.Cc1nc(C(C)C)cc(N2CCN(CCO)CC2)n1.Cc1nccc(C(C)C)n1.
What is the InChIKey of 4-chloro-6-propan-2-ylpyrimidine;N,N-dimethyl-4-propan-2-ylpyrimidin-2-amine;N,N-dimethyl-6-propan-2-ylpyrimidin-4-amine;2,4-dimethyl-6-propan-2-ylpyrimidine;4-(4-methylpiperazin-1-yl)-6-propan-2-ylpyrimidine;bis(2-methyl-5-propan-2-ylpyrazine);2-methyl-4-propan-2-ylpyrimidine;2-[4-(2-methyl-6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol;2-[4-(4-methyl-6-propan-2-ylpyrimidin-2-yl)piperazin-1-yl]ethanol;5-propan-2-ylpyrazin-2-amine;2-propan-2-ylpyrazine;2-[4-(5-propan-2-ylpyrazin-2-yl)piperazin-1-yl]ethanol;3-propan-2-ylpyridazine;2-propan-2-ylpyrimidine;2-[(6-propan-2-ylpyrimidin-4-yl)amino]ethanol;4-(6-propan-2-ylpyrimidin-4-yl)morpholine;2-[4-(6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol?
The InChIKey is ACHGMRYCEWCNRU-UHFFFAOYSA-N. The full InChI is InChI=1S/2C14H24N4O.2C13H22N4O.C12H20N4.C11H17N3O.C9H15N3O.2C9H15N3.C9H14N2.3C8H12N2.C7H9ClN2.C7H11N3.3C7H10N2/c1-11(2)13-10-14(16-12(3)15-13)18-6-4-17(5-7-18)8-9-19;1-11(2)13-10-12(3)15-14(16-13)18-6-4-17(5-7-18)8-9-19;1-11(2)12-9-15-13(10-14-12)17-5-3-16(4-6-17)7-8-18;1-11(2)12-9-13(15-10-14-12)17-5-3-16(4-6-17)7-8-18;1-10(2)11-8-12(14-9-13-11)16-6-4-15(3)5-7-16;1-9(2)10-7-11(13-8-12-10)14-3-5-15-6-4-14;1-7(2)8-5-9(10-3-4-13)12-6-11-8;1-7(2)8-5-9(12(3)4)11-6-10-8;1-7(2)8-5-6-10-9(11-8)12(3)4;1-6(2)9-5-7(3)10-8(4)11-9;2*1-6(2)8-5-9-7(3)4-10-8;1-6(2)8-4-5-9-7(3)10-8;1-5(2)6-3-7(8)10-4-9-6;1-5(2)6-3-10-7(8)4-9-6;1-6(2)7-5-8-3-4-9-7;1-6(2)7-8-4-3-5-9-7;1-6(2)7-4-3-5-8-9-7/h2*10-11,19H,4-9H2,1-3H3;2*9-11,18H,3-8H2,1-2H3;8-10H,4-7H2,1-3H3;7-9H,3-6H2,1-2H3;5-7,13H,3-4H2,1-2H3,(H,10,11,12);2*5-7H,1-4H3;5-6H,1-4H3;3*4-6H,1-3H3;3-5H,1-2H3;3-5H,1-2H3,(H2,8,10);3*3-6H,1-2H3.
What are the key properties of 4-chloro-6-propan-2-ylpyrimidine;N,N-dimethyl-4-propan-2-ylpyrimidin-2-amine;N,N-dimethyl-6-propan-2-ylpyrimidin-4-amine;2,4-dimethyl-6-propan-2-ylpyrimidine;4-(4-methylpiperazin-1-yl)-6-propan-2-ylpyrimidine;bis(2-methyl-5-propan-2-ylpyrazine);2-methyl-4-propan-2-ylpyrimidine;2-[4-(2-methyl-6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol;2-[4-(4-methyl-6-propan-2-ylpyrimidin-2-yl)piperazin-1-yl]ethanol;5-propan-2-ylpyrazin-2-amine;2-propan-2-ylpyrazine;2-[4-(5-propan-2-ylpyrazin-2-yl)piperazin-1-yl]ethanol;3-propan-2-ylpyridazine;2-propan-2-ylpyrimidine;2-[(6-propan-2-ylpyrimidin-4-yl)amino]ethanol;4-(6-propan-2-ylpyrimidin-4-yl)morpholine;2-[4-(6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol?
4-chloro-6-propan-2-ylpyrimidine;N,N-dimethyl-4-propan-2-ylpyrimidin-2-amine;N,N-dimethyl-6-propan-2-ylpyrimidin-4-amine;2,4-dimethyl-6-propan-2-ylpyrimidine;4-(4-methylpiperazin-1-yl)-6-propan-2-ylpyrimidine;bis(2-methyl-5-propan-2-ylpyrazine);2-methyl-4-propan-2-ylpyrimidine;2-[4-(2-methyl-6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol;2-[4-(4-methyl-6-propan-2-ylpyrimidin-2-yl)piperazin-1-yl]ethanol;5-propan-2-ylpyrazin-2-amine;2-propan-2-ylpyrazine;2-[4-(5-propan-2-ylpyrazin-2-yl)piperazin-1-yl]ethanol;3-propan-2-ylpyridazine;2-propan-2-ylpyrimidine;2-[(6-propan-2-ylpyrimidin-4-yl)amino]ethanol;4-(6-propan-2-ylpyrimidin-4-yl)morpholine;2-[4-(6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol has a molecular weight of 3187.89 g/mol, XLogP of 26.78, 37 rotatable bonds, 7 hydrogen bond donors, and 57 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-6-propan-2-ylpyrimidine;N,N-dimethyl-4-propan-2-ylpyrimidin-2-amine;N,N-dimethyl-6-propan-2-ylpyrimidin-4-amine;2,4-dimethyl-6-propan-2-ylpyrimidine;4-(4-methylpiperazin-1-yl)-6-propan-2-ylpyrimidine;bis(2-methyl-5-propan-2-ylpyrazine);2-methyl-4-propan-2-ylpyrimidine;2-[4-(2-methyl-6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol;2-[4-(4-methyl-6-propan-2-ylpyrimidin-2-yl)piperazin-1-yl]ethanol;5-propan-2-ylpyrazin-2-amine;2-propan-2-ylpyrazine;2-[4-(5-propan-2-ylpyrazin-2-yl)piperazin-1-yl]ethanol;3-propan-2-ylpyridazine;2-propan-2-ylpyrimidine;2-[(6-propan-2-ylpyrimidin-4-yl)amino]ethanol;4-(6-propan-2-ylpyrimidin-4-yl)morpholine;2-[4-(6-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanol is sourced from PubChem (CID 157069786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).