3-chloro-5-(1,5-dimethyl-4-propan-2-ylpyrazol-3-yl)pyridine;3-(3-chlorophenyl)-1,5-dimethyl-4-propan-2-ylpyrazole;5-(4-chlorophenyl)-3-methyl-4-propan-2-yl-2H-pyrrole;1,5-dimethyl-3-phenyl-4-propan-2-ylpyrazole;4-[5-methyl-1,4-di(propan-2-yl)pyrazol-3-yl]pyridine;5-methyl-3-phenyl-1,4-di(propan-2-yl)pyrazole;(5-methyl-3-phenyl-4-propan-2-ylpyrazol-1-yl)-(1-methylpiperidin-4-yl)methanone;(1-methyl-3-phenyl-4-propan-2-ylpyrazol-5-yl)-morpholin-4-ylmethanone;3-methyl-5-phenyl-4-propan-2-yl-2H-pyrrole;(2-methyl-5-phenyl-4-propan-2-yl-1H-pyrrol-3-yl)-morpholin-4-ylmethanone;1-(2-methyl-5-phenyl-4-propan-2-yl-1H-pyrrol-3-yl)propan-1-one

C174H222Cl3N23O6 — CID 159001810

IUPAC3-chloro-5-(1,5-dimethyl-4-propan-2-ylpyrazol-3-yl)pyridine;3-(3-chlorophenyl)-1,5-dimethyl-4-propan-2-ylpyrazole;5-(4-chlorophenyl)-3-methyl-4-propan-2-yl-2H-pyrrole;1,5-dimethyl-3-phenyl-4-propan-2-ylpyrazole;4-[5-methyl-1,4-di(propan-2-yl)pyrazol-3-yl]pyridine;5-methyl-3-phenyl-1,4-di(propan-2-yl)pyrazole;(5-methyl-3-phenyl-4-propan-2-ylpyrazol-1-yl)-(1-methylpiperidin-4-yl)methanone;(1-methyl-3-phenyl-4-propan-2-ylpyrazol-5-yl)-morpholin-4-ylmethanone;3-methyl-5-phenyl-4-propan-2-yl-2H-pyrrole;(2-methyl-5-phenyl-4-propan-2-yl-1H-pyrrol-3-yl)-morpholin-4-ylmethanone;1-(2-methyl-5-phenyl-4-propan-2-yl-1H-pyrrol-3-yl)propan-1-one
SMILESCC(C)c1c(-c2ccccc2)nn(C)c1C(=O)N1CCOCC1.CC1=C(C(C)C)C(c2ccc(Cl)cc2)=NC1.CC1=C(C(C)C)C(c2ccccc2)=NC1.CCC(=O)c1c(C)[nH]c(-c2ccccc2)c1C(C)C.Cc1[nH]c(-c2ccccc2)c(C(C)C)c1C(=O)N1CCOCC1.Cc1c(C(C)C)c(-c2cccc(Cl)c2)nn1C.Cc1c(C(C)C)c(-c2ccccc2)nn1C.Cc1c(C(C)C)c(-c2ccccc2)nn1C(=O)C1CCN(C)CC1.Cc1c(C(C)C)c(-c2ccccc2)nn1C(C)C.Cc1c(C(C)C)c(-c2ccncc2)nn1C(C)C.Cc1c(C(C)C)c(-c2cncc(Cl)c2)nn1C
InChIInChI=1S/C20H27N3O.C19H24N2O2.C18H23N3O2.C17H21NO.C16H22N2.C15H21N3.C14H17ClN2.C14H16ClN.C14H18N2.C14H17N.C13H16ClN3/c1-14(2)18-15(3)23(20(24)17-10-12-22(4)13-11-17)21-19(18)16-8-6-5-7-9-16;1-13(2)16-17(19(22)21-9-11-23-12-10-21)14(3)20-18(16)15-7-5-4-6-8-15;1-13(2)15-16(14-7-5-4-6-8-14)19-20(3)17(15)18(22)21-9-11-23-12-10-21;1-5-14(19)16-12(4)18-17(15(16)11(2)3)13-9-7-6-8-10-13;1-11(2)15-13(5)18(12(3)4)17-16(15)14-9-7-6-8-10-14;1-10(2)14-12(5)18(11(3)4)17-15(14)13-6-8-16-9-7-13;1-9(2)13-10(3)17(4)16-14(13)11-6-5-7-12(15)8-11;1-9(2)13-10(3)8-16-14(13)11-4-6-12(15)7-5-11;1-10(2)13-11(3)16(4)15-14(13)12-8-6-5-7-9-12;1-10(2)13-11(3)9-15-14(13)12-7-5-4-6-8-12;1-8(2)12-9(3)17(4)16-13(12)10-5-11(14)7-15-6-10/h5-9,14,17H,10-13H2,1-4H3;4-8,13,20H,9-12H2,1-3H3;4-8,13H,9-12H2,1-3H3;6-11,18H,5H2,1-4H3;6-12H,1-5H3;6-11H,1-5H3;5-9H,1-4H3;4-7,9H,8H2,1-3H3;5-10H,1-4H3;4-8,10H,9H2,1-3H3;5-8H,1-4H3
InChIKeyJRKSXGMVJAPQCR-UHFFFAOYSA-N
MW2838.20 g/mol
LogP42.30
Rot. Bonds29

About 3-chloro-5-(1,5-dimethyl-4-propan-2-ylpyrazol-3-yl)pyridine;3-(3-chlorophenyl)-1,5-dimethyl-4-propan-2-ylpyrazole;5-(4-chlorophenyl)-3-methyl-4-propan-2-yl-2H-pyrrole;1,5-dimethyl-3-phenyl-4-propan-2-ylpyrazole;4-[5-methyl-1,4-di(propan-2-yl)pyrazol-3-yl]pyridine;5-methyl-3-phenyl-1,4-di(propan-2-yl)pyrazole;(5-methyl-3-phenyl-4-propan-2-ylpyrazol-1-yl)-(1-methylpiperidin-4-yl)methanone;(1-methyl-3-phenyl-4-propan-2-ylpyrazol-5-yl)-morpholin-4-ylmethanone;3-methyl-5-phenyl-4-propan-2-yl-2H-pyrrole;(2-methyl-5-phenyl-4-propan-2-yl-1H-pyrrol-3-yl)-morpholin-4-ylmethanone;1-(2-methyl-5-phenyl-4-propan-2-yl-1H-pyrrol-3-yl)propan-1-one

3-chloro-5-(1,5-dimethyl-4-propan-2-ylpyrazol-3-yl)pyridine;3-(3-chlorophenyl)-1,5-dimethyl-4-propan-2-ylpyrazole;5-(4-chlorophenyl)-3-methyl-4-propan-2-yl-2H-pyrrole;1,5-dimethyl-3-phenyl-4-propan-2-ylpyrazole;4-[5-methyl-1,4-di(propan-2-yl)pyrazol-3-yl]pyridine;5-methyl-3-phenyl-1,4-di(propan-2-yl)pyrazole;(5-methyl-3-phenyl-4-propan-2-ylpyrazol-1-yl)-(1-methylpiperidin-4-yl)methanone;(1-methyl-3-phenyl-4-propan-2-ylpyrazol-5-yl)-morpholin-4-ylmethanone;3-methyl-5-phenyl-4-propan-2-yl-2H-pyrrole;(2-methyl-5-phenyl-4-propan-2-yl-1H-pyrrol-3-yl)-morpholin-4-ylmethanone;1-(2-methyl-5-phenyl-4-propan-2-yl-1H-pyrrol-3-yl)propan-1-one (PubChem CID 159001810) has the molecular formula C174H222Cl3N23O6 and a molecular weight of 2838.20 g/mol. Its IUPAC name is 3-chloro-5-(1,5-dimethyl-4-propan-2-ylpyrazol-3-yl)pyridine;3-(3-chlorophenyl)-1,5-dimethyl-4-propan-2-ylpyrazole;5-(4-chlorophenyl)-3-methyl-4-propan-2-yl-2H-pyrrole;1,5-dimethyl-3-phenyl-4-propan-2-ylpyrazole;4-[5-methyl-1,4-di(propan-2-yl)pyrazol-3-yl]pyridine;5-methyl-3-phenyl-1,4-di(propan-2-yl)pyrazole;(5-methyl-3-phenyl-4-propan-2-ylpyrazol-1-yl)-(1-methylpiperidin-4-yl)methanone;(1-methyl-3-phenyl-4-propan-2-ylpyrazol-5-yl)-morpholin-4-ylmethanone;3-methyl-5-phenyl-4-propan-2-yl-2H-pyrrole;(2-methyl-5-phenyl-4-propan-2-yl-1H-pyrrol-3-yl)-morpholin-4-ylmethanone;1-(2-methyl-5-phenyl-4-propan-2-yl-1H-pyrrol-3-yl)propan-1-one.

Molecular Properties

Compound Name3-chloro-5-(1,5-dimethyl-4-propan-2-ylpyrazol-3-yl)pyridine;3-(3-chlorophenyl)-1,5-dimethyl-4-propan-2-ylpyrazole;5-(4-chlorophenyl)-3-methyl-4-propan-2-yl-2H-pyrrole;1,5-dimethyl-3-phenyl-4-propan-2-ylpyrazole;4-[5-methyl-1,4-di(propan-2-yl)pyrazol-3-yl]pyridine;5-methyl-3-phenyl-1,4-di(propan-2-yl)pyrazole;(5-methyl-3-phenyl-4-propan-2-ylpyrazol-1-yl)-(1-methylpiperidin-4-yl)methanone;(1-methyl-3-phenyl-4-propan-2-ylpyrazol-5-yl)-morpholin-4-ylmethanone;3-methyl-5-phenyl-4-propan-2-yl-2H-pyrrole;(2-methyl-5-phenyl-4-propan-2-yl-1H-pyrrol-3-yl)-morpholin-4-ylmethanone;1-(2-methyl-5-phenyl-4-propan-2-yl-1H-pyrrol-3-yl)propan-1-one
PubChem CID159001810
Molecular FormulaC174H222Cl3N23O6
Molecular Weight2838.20 g/mol
Exact Mass2834.68
IUPAC Name3-chloro-5-(1,5-dimethyl-4-propan-2-ylpyrazol-3-yl)pyridine;3-(3-chlorophenyl)-1,5-dimethyl-4-propan-2-ylpyrazole;5-(4-chlorophenyl)-3-methyl-4-propan-2-yl-2H-pyrrole;1,5-dimethyl-3-phenyl-4-propan-2-ylpyrazole;4-[5-methyl-1,4-di(propan-2-yl)pyrazol-3-yl]pyridine;5-methyl-3-phenyl-1,4-di(propan-2-yl)pyrazole;(5-methyl-3-phenyl-4-propan-2-ylpyrazol-1-yl)-(1-methylpiperidin-4-yl)methanone;(1-methyl-3-phenyl-4-propan-2-ylpyrazol-5-yl)-morpholin-4-ylmethanone;3-methyl-5-phenyl-4-propan-2-yl-2H-pyrrole;(2-methyl-5-phenyl-4-propan-2-yl-1H-pyrrol-3-yl)-morpholin-4-ylmethanone;1-(2-methyl-5-phenyl-4-propan-2-yl-1H-pyrrol-3-yl)propan-1-one
SMILESCC(C)c1c(-c2ccccc2)nn(C)c1C(=O)N1CCOCC1.CC1=C(C(C)C)C(c2ccc(Cl)cc2)=NC1.CC1=C(C(C)C)C(c2ccccc2)=NC1.CCC(=O)c1c(C)[nH]c(-c2ccccc2)c1C(C)C.Cc1[nH]c(-c2ccccc2)c(C(C)C)c1C(=O)N1CCOCC1.Cc1c(C(C)C)c(-c2cccc(Cl)c2)nn1C.Cc1c(C(C)C)c(-c2ccccc2)nn1C.Cc1c(C(C)C)c(-c2ccccc2)nn1C(=O)C1CCN(C)CC1.Cc1c(C(C)C)c(-c2ccccc2)nn1C(C)C.Cc1c(C(C)C)c(-c2ccncc2)nn1C(C)C.Cc1c(C(C)C)c(-c2cncc(Cl)c2)nn1C
InChIInChI=1S/C20H27N3O.C19H24N2O2.C18H23N3O2.C17H21NO.C16H22N2.C15H21N3.C14H17ClN2.C14H16ClN.C14H18N2.C14H17N.C13H16ClN3/c1-14(2)18-15(3)23(20(24)17-10-12-22(4)13-11-17)21-19(18)16-8-6-5-7-9-16;1-13(2)16-17(19(22)21-9-11-23-12-10-21)14(3)20-18(16)15-7-5-4-6-8-15;1-13(2)15-16(14-7-5-4-6-8-14)19-20(3)17(15)18(22)21-9-11-23-12-10-21;1-5-14(19)16-12(4)18-17(15(16)11(2)3)13-9-7-6-8-10-13;1-11(2)15-13(5)18(12(3)4)17-16(15)14-9-7-6-8-10-14;1-10(2)14-12(5)18(11(3)4)17-15(14)13-6-8-16-9-7-13;1-9(2)13-10(3)17(4)16-14(13)11-6-5-7-12(15)8-11;1-9(2)13-10(3)8-16-14(13)11-4-6-12(15)7-5-11;1-10(2)13-11(3)16(4)15-14(13)12-8-6-5-7-9-12;1-10(2)13-11(3)9-15-14(13)12-7-5-4-6-8-12;1-8(2)12-9(3)17(4)16-13(12)10-5-11(14)7-15-6-10/h5-9,14,17H,10-13H2,1-4H3;4-8,13,20H,9-12H2,1-3H3;4-8,13H,9-12H2,1-3H3;6-11,18H,5H2,1-4H3;6-12H,1-5H3;6-11H,1-5H3;5-9H,1-4H3;4-7,9H,8H2,1-3H3;5-10H,1-4H3;4-8,10H,9H2,1-3H3;5-8H,1-4H3
InChIKeyJRKSXGMVJAPQCR-UHFFFAOYSA-N
XLogP42.30
TPSA303.28 Ų
H-Bond Donors2
H-Bond Acceptors25
Rotatable Bonds29
Heavy Atoms206
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002838.20
LogP ≤ 542.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1025

Analyze 3-chloro-5-(1,5-dimethyl-4-propan-2-ylpyrazol-3-yl)pyridine;3-(3-chlorophenyl)-1,5-dimethyl-4-propan-2-ylpyrazole;5-(4-chlorophenyl)-3-methyl-4-propan-2-yl-2H-pyrrole;1,5-dimethyl-3-phenyl-4-propan-2-ylpyrazole;4-[5-methyl-1,4-di(propan-2-yl)pyrazol-3-yl]pyridine;5-methyl-3-phenyl-1,4-di(propan-2-yl)pyrazole;(5-methyl-3-phenyl-4-propan-2-ylpyrazol-1-yl)-(1-methylpiperidin-4-yl)methanone;(1-methyl-3-phenyl-4-propan-2-ylpyrazol-5-yl)-morpholin-4-ylmethanone;3-methyl-5-phenyl-4-propan-2-yl-2H-pyrrole;(2-methyl-5-phenyl-4-propan-2-yl-1H-pyrrol-3-yl)-morpholin-4-ylmethanone;1-(2-methyl-5-phenyl-4-propan-2-yl-1H-pyrrol-3-yl)propan-1-one with MolForge

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Launch Full Analysis

Related Compounds

(2-methyl-5-phenyl-4-propan-2-yl-1H-pyrrol-3-yl)-morpholin-4-ylmethanone
CID 118344835
3-(3-chlorophenyl)-1,5-dimethylpyrazole-4-carboxylic acid
CID 122619967
(5-methyl-1,3-diphenylpyrazol-4-yl)-morpholin-4-ylmethanone
CID 3079318
[8-(3-chlorophenyl)-4,7-dimethylpyrazolo[5,1-c][1,2,4]triazin-3-yl]-morpholin-4-ylmethanone
CID 43840841
2-(5-chloro-3-phenylindazol-1-yl)-1-morpholin-4-ylpropan-1-one
CID 20877476
[4-amino-6-(3-chlorophenyl)-1-methylimidazo[4,5-c]pyridin-7-yl]-morpholin-4-ylmethanone
CID 69192466
3-(4-chlorophenyl)-N-[1-ethyl-5-(morpholine-4-carbonyl)pyrazol-4-yl]-1H-pyrazole-5-carboxamide
CID 19509579
3,3-diphenylpropyl 4-(3-chlorophenyl)-2,6-dimethyl-5-(morpholine-4-carbonyl)pyridine-3-carboxylate
CID 58981789
2-[1-[3-(3-methylphenyl)-1-phenylpyrazole-4-carbonyl]piperidin-4-yl]-1-morpholin-4-ylethanone
CID 46377888
[1-(3-chlorobenzoyl)piperidin-4-yl]-morpholin-4-ylmethanone
CID 38490514
(4-benzylpiperidin-1-yl)-[3-(4-chlorophenyl)-5-[(1S)-1-hydroxyethyl]-1,2-oxazol-4-yl]methanone
CID 100632464
6-(4-chlorophenyl)-N-ethyl-5-(hydroxymethyl)-N-methylimidazo[2,1-b][1,3]thiazole-2-carboxamide;[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]-cyclopropylmethanol;1-[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]ethanol;[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]-(4-methylpiperazin-1-yl)methanone;[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]-morpholin-4-ylmethanone;2-[6-(4-chlorophenyl)-5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-2-yl]propan-2-ol
CID 161207585

Frequently Asked Questions

What is the IUPAC name of 3-chloro-5-(1,5-dimethyl-4-propan-2-ylpyrazol-3-yl)pyridine;3-(3-chlorophenyl)-1,5-dimethyl-4-propan-2-ylpyrazole;5-(4-chlorophenyl)-3-methyl-4-propan-2-yl-2H-pyrrole;1,5-dimethyl-3-phenyl-4-propan-2-ylpyrazole;4-[5-methyl-1,4-di(propan-2-yl)pyrazol-3-yl]pyridine;5-methyl-3-phenyl-1,4-di(propan-2-yl)pyrazole;(5-methyl-3-phenyl-4-propan-2-ylpyrazol-1-yl)-(1-methylpiperidin-4-yl)methanone;(1-methyl-3-phenyl-4-propan-2-ylpyrazol-5-yl)-morpholin-4-ylmethanone;3-methyl-5-phenyl-4-propan-2-yl-2H-pyrrole;(2-methyl-5-phenyl-4-propan-2-yl-1H-pyrrol-3-yl)-morpholin-4-ylmethanone;1-(2-methyl-5-phenyl-4-propan-2-yl-1H-pyrrol-3-yl)propan-1-one?
The IUPAC name of 3-chloro-5-(1,5-dimethyl-4-propan-2-ylpyrazol-3-yl)pyridine;3-(3-chlorophenyl)-1,5-dimethyl-4-propan-2-ylpyrazole;5-(4-chlorophenyl)-3-methyl-4-propan-2-yl-2H-pyrrole;1,5-dimethyl-3-phenyl-4-propan-2-ylpyrazole;4-[5-methyl-1,4-di(propan-2-yl)pyrazol-3-yl]pyridine;5-methyl-3-phenyl-1,4-di(propan-2-yl)pyrazole;(5-methyl-3-phenyl-4-propan-2-ylpyrazol-1-yl)-(1-methylpiperidin-4-yl)methanone;(1-methyl-3-phenyl-4-propan-2-ylpyrazol-5-yl)-morpholin-4-ylmethanone;3-methyl-5-phenyl-4-propan-2-yl-2H-pyrrole;(2-methyl-5-phenyl-4-propan-2-yl-1H-pyrrol-3-yl)-morpholin-4-ylmethanone;1-(2-methyl-5-phenyl-4-propan-2-yl-1H-pyrrol-3-yl)propan-1-one (CID 159001810) is 3-chloro-5-(1,5-dimethyl-4-propan-2-ylpyrazol-3-yl)pyridine;3-(3-chlorophenyl)-1,5-dimethyl-4-propan-2-ylpyrazole;5-(4-chlorophenyl)-3-methyl-4-propan-2-yl-2H-pyrrole;1,5-dimethyl-3-phenyl-4-propan-2-ylpyrazole;4-[5-methyl-1,4-di(propan-2-yl)pyrazol-3-yl]pyridine;5-methyl-3-phenyl-1,4-di(propan-2-yl)pyrazole;(5-methyl-3-phenyl-4-propan-2-ylpyrazol-1-yl)-(1-methylpiperidin-4-yl)methanone;(1-methyl-3-phenyl-4-propan-2-ylpyrazol-5-yl)-morpholin-4-ylmethanone;3-methyl-5-phenyl-4-propan-2-yl-2H-pyrrole;(2-methyl-5-phenyl-4-propan-2-yl-1H-pyrrol-3-yl)-morpholin-4-ylmethanone;1-(2-methyl-5-phenyl-4-propan-2-yl-1H-pyrrol-3-yl)propan-1-one.
What is the SMILES notation for 3-chloro-5-(1,5-dimethyl-4-propan-2-ylpyrazol-3-yl)pyridine;3-(3-chlorophenyl)-1,5-dimethyl-4-propan-2-ylpyrazole;5-(4-chlorophenyl)-3-methyl-4-propan-2-yl-2H-pyrrole;1,5-dimethyl-3-phenyl-4-propan-2-ylpyrazole;4-[5-methyl-1,4-di(propan-2-yl)pyrazol-3-yl]pyridine;5-methyl-3-phenyl-1,4-di(propan-2-yl)pyrazole;(5-methyl-3-phenyl-4-propan-2-ylpyrazol-1-yl)-(1-methylpiperidin-4-yl)methanone;(1-methyl-3-phenyl-4-propan-2-ylpyrazol-5-yl)-morpholin-4-ylmethanone;3-methyl-5-phenyl-4-propan-2-yl-2H-pyrrole;(2-methyl-5-phenyl-4-propan-2-yl-1H-pyrrol-3-yl)-morpholin-4-ylmethanone;1-(2-methyl-5-phenyl-4-propan-2-yl-1H-pyrrol-3-yl)propan-1-one?
The canonical SMILES for 3-chloro-5-(1,5-dimethyl-4-propan-2-ylpyrazol-3-yl)pyridine;3-(3-chlorophenyl)-1,5-dimethyl-4-propan-2-ylpyrazole;5-(4-chlorophenyl)-3-methyl-4-propan-2-yl-2H-pyrrole;1,5-dimethyl-3-phenyl-4-propan-2-ylpyrazole;4-[5-methyl-1,4-di(propan-2-yl)pyrazol-3-yl]pyridine;5-methyl-3-phenyl-1,4-di(propan-2-yl)pyrazole;(5-methyl-3-phenyl-4-propan-2-ylpyrazol-1-yl)-(1-methylpiperidin-4-yl)methanone;(1-methyl-3-phenyl-4-propan-2-ylpyrazol-5-yl)-morpholin-4-ylmethanone;3-methyl-5-phenyl-4-propan-2-yl-2H-pyrrole;(2-methyl-5-phenyl-4-propan-2-yl-1H-pyrrol-3-yl)-morpholin-4-ylmethanone;1-(2-methyl-5-phenyl-4-propan-2-yl-1H-pyrrol-3-yl)propan-1-one is CC(C)c1c(-c2ccccc2)nn(C)c1C(=O)N1CCOCC1.CC1=C(C(C)C)C(c2ccc(Cl)cc2)=NC1.CC1=C(C(C)C)C(c2ccccc2)=NC1.CCC(=O)c1c(C)[nH]c(-c2ccccc2)c1C(C)C.Cc1[nH]c(-c2ccccc2)c(C(C)C)c1C(=O)N1CCOCC1.Cc1c(C(C)C)c(-c2cccc(Cl)c2)nn1C.Cc1c(C(C)C)c(-c2ccccc2)nn1C.Cc1c(C(C)C)c(-c2ccccc2)nn1C(=O)C1CCN(C)CC1.Cc1c(C(C)C)c(-c2ccccc2)nn1C(C)C.Cc1c(C(C)C)c(-c2ccncc2)nn1C(C)C.Cc1c(C(C)C)c(-c2cncc(Cl)c2)nn1C.
What is the InChIKey of 3-chloro-5-(1,5-dimethyl-4-propan-2-ylpyrazol-3-yl)pyridine;3-(3-chlorophenyl)-1,5-dimethyl-4-propan-2-ylpyrazole;5-(4-chlorophenyl)-3-methyl-4-propan-2-yl-2H-pyrrole;1,5-dimethyl-3-phenyl-4-propan-2-ylpyrazole;4-[5-methyl-1,4-di(propan-2-yl)pyrazol-3-yl]pyridine;5-methyl-3-phenyl-1,4-di(propan-2-yl)pyrazole;(5-methyl-3-phenyl-4-propan-2-ylpyrazol-1-yl)-(1-methylpiperidin-4-yl)methanone;(1-methyl-3-phenyl-4-propan-2-ylpyrazol-5-yl)-morpholin-4-ylmethanone;3-methyl-5-phenyl-4-propan-2-yl-2H-pyrrole;(2-methyl-5-phenyl-4-propan-2-yl-1H-pyrrol-3-yl)-morpholin-4-ylmethanone;1-(2-methyl-5-phenyl-4-propan-2-yl-1H-pyrrol-3-yl)propan-1-one?
The InChIKey is JRKSXGMVJAPQCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27N3O.C19H24N2O2.C18H23N3O2.C17H21NO.C16H22N2.C15H21N3.C14H17ClN2.C14H16ClN.C14H18N2.C14H17N.C13H16ClN3/c1-14(2)18-15(3)23(20(24)17-10-12-22(4)13-11-17)21-19(18)16-8-6-5-7-9-16;1-13(2)16-17(19(22)21-9-11-23-12-10-21)14(3)20-18(16)15-7-5-4-6-8-15;1-13(2)15-16(14-7-5-4-6-8-14)19-20(3)17(15)18(22)21-9-11-23-12-10-21;1-5-14(19)16-12(4)18-17(15(16)11(2)3)13-9-7-6-8-10-13;1-11(2)15-13(5)18(12(3)4)17-16(15)14-9-7-6-8-10-14;1-10(2)14-12(5)18(11(3)4)17-15(14)13-6-8-16-9-7-13;1-9(2)13-10(3)17(4)16-14(13)11-6-5-7-12(15)8-11;1-9(2)13-10(3)8-16-14(13)11-4-6-12(15)7-5-11;1-10(2)13-11(3)16(4)15-14(13)12-8-6-5-7-9-12;1-10(2)13-11(3)9-15-14(13)12-7-5-4-6-8-12;1-8(2)12-9(3)17(4)16-13(12)10-5-11(14)7-15-6-10/h5-9,14,17H,10-13H2,1-4H3;4-8,13,20H,9-12H2,1-3H3;4-8,13H,9-12H2,1-3H3;6-11,18H,5H2,1-4H3;6-12H,1-5H3;6-11H,1-5H3;5-9H,1-4H3;4-7,9H,8H2,1-3H3;5-10H,1-4H3;4-8,10H,9H2,1-3H3;5-8H,1-4H3.
What are the key properties of 3-chloro-5-(1,5-dimethyl-4-propan-2-ylpyrazol-3-yl)pyridine;3-(3-chlorophenyl)-1,5-dimethyl-4-propan-2-ylpyrazole;5-(4-chlorophenyl)-3-methyl-4-propan-2-yl-2H-pyrrole;1,5-dimethyl-3-phenyl-4-propan-2-ylpyrazole;4-[5-methyl-1,4-di(propan-2-yl)pyrazol-3-yl]pyridine;5-methyl-3-phenyl-1,4-di(propan-2-yl)pyrazole;(5-methyl-3-phenyl-4-propan-2-ylpyrazol-1-yl)-(1-methylpiperidin-4-yl)methanone;(1-methyl-3-phenyl-4-propan-2-ylpyrazol-5-yl)-morpholin-4-ylmethanone;3-methyl-5-phenyl-4-propan-2-yl-2H-pyrrole;(2-methyl-5-phenyl-4-propan-2-yl-1H-pyrrol-3-yl)-morpholin-4-ylmethanone;1-(2-methyl-5-phenyl-4-propan-2-yl-1H-pyrrol-3-yl)propan-1-one?
3-chloro-5-(1,5-dimethyl-4-propan-2-ylpyrazol-3-yl)pyridine;3-(3-chlorophenyl)-1,5-dimethyl-4-propan-2-ylpyrazole;5-(4-chlorophenyl)-3-methyl-4-propan-2-yl-2H-pyrrole;1,5-dimethyl-3-phenyl-4-propan-2-ylpyrazole;4-[5-methyl-1,4-di(propan-2-yl)pyrazol-3-yl]pyridine;5-methyl-3-phenyl-1,4-di(propan-2-yl)pyrazole;(5-methyl-3-phenyl-4-propan-2-ylpyrazol-1-yl)-(1-methylpiperidin-4-yl)methanone;(1-methyl-3-phenyl-4-propan-2-ylpyrazol-5-yl)-morpholin-4-ylmethanone;3-methyl-5-phenyl-4-propan-2-yl-2H-pyrrole;(2-methyl-5-phenyl-4-propan-2-yl-1H-pyrrol-3-yl)-morpholin-4-ylmethanone;1-(2-methyl-5-phenyl-4-propan-2-yl-1H-pyrrol-3-yl)propan-1-one has a molecular weight of 2838.20 g/mol, XLogP of 42.30, 29 rotatable bonds, 2 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-5-(1,5-dimethyl-4-propan-2-ylpyrazol-3-yl)pyridine;3-(3-chlorophenyl)-1,5-dimethyl-4-propan-2-ylpyrazole;5-(4-chlorophenyl)-3-methyl-4-propan-2-yl-2H-pyrrole;1,5-dimethyl-3-phenyl-4-propan-2-ylpyrazole;4-[5-methyl-1,4-di(propan-2-yl)pyrazol-3-yl]pyridine;5-methyl-3-phenyl-1,4-di(propan-2-yl)pyrazole;(5-methyl-3-phenyl-4-propan-2-ylpyrazol-1-yl)-(1-methylpiperidin-4-yl)methanone;(1-methyl-3-phenyl-4-propan-2-ylpyrazol-5-yl)-morpholin-4-ylmethanone;3-methyl-5-phenyl-4-propan-2-yl-2H-pyrrole;(2-methyl-5-phenyl-4-propan-2-yl-1H-pyrrol-3-yl)-morpholin-4-ylmethanone;1-(2-methyl-5-phenyl-4-propan-2-yl-1H-pyrrol-3-yl)propan-1-one is sourced from PubChem (CID 159001810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).