6-ethyl-N-[4-[(3S)-piperidin-3-yl]phenyl]pyridine-3-carboxamide;N-(4-morpholin-2-ylphenyl)-2-pyrazin-2-yl-1,3-thiazole-4-carboxamide;N-[4-[(3S)-piperidin-3-yl]phenyl]-6-propylpyridine-3-carboxamide

C57H65N11O4S — CID 162038188

IUPAC6-ethyl-N-[4-[(3S)-piperidin-3-yl]phenyl]pyridine-3-carboxamide;N-(4-morpholin-2-ylphenyl)-2-pyrazin-2-yl-1,3-thiazole-4-carboxamide;N-[4-[(3S)-piperidin-3-yl]phenyl]-6-propylpyridine-3-carboxamide
SMILESCCCc1ccc(C(=O)Nc2ccc([C@@H]3CCCNC3)cc2)cn1.CCc1ccc(C(=O)Nc2ccc([C@@H]3CCCNC3)cc2)cn1.O=C(Nc1ccc(C2CNCCO2)cc1)c1csc(-c2cnccn2)n1
InChIInChI=1S/C20H25N3O.C19H23N3O.C18H17N5O2S/c1-2-4-18-9-8-17(14-22-18)20(24)23-19-10-6-15(7-11-19)16-5-3-12-21-13-16;1-2-17-8-7-16(13-21-17)19(23)22-18-9-5-14(6-10-18)15-4-3-11-20-12-15;24-17(15-11-26-18(23-15)14-9-19-5-6-21-14)22-13-3-1-12(2-4-13)16-10-20-7-8-25-16/h6-11,14,16,21H,2-5,12-13H2,1H3,(H,23,24);5-10,13,15,20H,2-4,11-12H2,1H3,(H,22,23);1-6,9,11,16,20H,7-8,10H2,(H,22,24)/t16-;15-;/m11./s1
InChIKeyYWXRAMZPYXCENW-UKYNRDOCSA-N
MW1000.29 g/mol
LogP9.63
Rot. Bonds13

About 6-ethyl-N-[4-[(3S)-piperidin-3-yl]phenyl]pyridine-3-carboxamide;N-(4-morpholin-2-ylphenyl)-2-pyrazin-2-yl-1,3-thiazole-4-carboxamide;N-[4-[(3S)-piperidin-3-yl]phenyl]-6-propylpyridine-3-carboxamide

6-ethyl-N-[4-[(3S)-piperidin-3-yl]phenyl]pyridine-3-carboxamide;N-(4-morpholin-2-ylphenyl)-2-pyrazin-2-yl-1,3-thiazole-4-carboxamide;N-[4-[(3S)-piperidin-3-yl]phenyl]-6-propylpyridine-3-carboxamide (PubChem CID 162038188) has the molecular formula C57H65N11O4S and a molecular weight of 1000.29 g/mol. Its IUPAC name is 6-ethyl-N-[4-[(3S)-piperidin-3-yl]phenyl]pyridine-3-carboxamide;N-(4-morpholin-2-ylphenyl)-2-pyrazin-2-yl-1,3-thiazole-4-carboxamide;N-[4-[(3S)-piperidin-3-yl]phenyl]-6-propylpyridine-3-carboxamide.

Molecular Properties

Compound Name6-ethyl-N-[4-[(3S)-piperidin-3-yl]phenyl]pyridine-3-carboxamide;N-(4-morpholin-2-ylphenyl)-2-pyrazin-2-yl-1,3-thiazole-4-carboxamide;N-[4-[(3S)-piperidin-3-yl]phenyl]-6-propylpyridine-3-carboxamide
PubChem CID162038188
Molecular FormulaC57H65N11O4S
Molecular Weight1000.29 g/mol
Exact Mass999.49
IUPAC Name6-ethyl-N-[4-[(3S)-piperidin-3-yl]phenyl]pyridine-3-carboxamide;N-(4-morpholin-2-ylphenyl)-2-pyrazin-2-yl-1,3-thiazole-4-carboxamide;N-[4-[(3S)-piperidin-3-yl]phenyl]-6-propylpyridine-3-carboxamide
SMILESCCCc1ccc(C(=O)Nc2ccc([C@@H]3CCCNC3)cc2)cn1.CCc1ccc(C(=O)Nc2ccc([C@@H]3CCCNC3)cc2)cn1.O=C(Nc1ccc(C2CNCCO2)cc1)c1csc(-c2cnccn2)n1
InChIInChI=1S/C20H25N3O.C19H23N3O.C18H17N5O2S/c1-2-4-18-9-8-17(14-22-18)20(24)23-19-10-6-15(7-11-19)16-5-3-12-21-13-16;1-2-17-8-7-16(13-21-17)19(23)22-18-9-5-14(6-10-18)15-4-3-11-20-12-15;24-17(15-11-26-18(23-15)14-9-19-5-6-21-14)22-13-3-1-12(2-4-13)16-10-20-7-8-25-16/h6-11,14,16,21H,2-5,12-13H2,1H3,(H,23,24);5-10,13,15,20H,2-4,11-12H2,1H3,(H,22,23);1-6,9,11,16,20H,7-8,10H2,(H,22,24)/t16-;15-;/m11./s1
InChIKeyYWXRAMZPYXCENW-UKYNRDOCSA-N
XLogP9.63
TPSA197.07 Ų
H-Bond Donors6
H-Bond Acceptors13
Rotatable Bonds13
Heavy Atoms73
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001000.29
LogP ≤ 59.63
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1013

Analyze 6-ethyl-N-[4-[(3S)-piperidin-3-yl]phenyl]pyridine-3-carboxamide;N-(4-morpholin-2-ylphenyl)-2-pyrazin-2-yl-1,3-thiazole-4-carboxamide;N-[4-[(3S)-piperidin-3-yl]phenyl]-6-propylpyridine-3-carboxamide with MolForge

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Related Compounds

N-(4-morpholin-2-ylphenyl)-2-pyrazin-2-yl-1,3-thiazole-4-carboxamide
CID 67238911
4-methyl-N-(4-morpholin-2-ylphenyl)-2-pyrazin-2-yl-1,3-thiazole-5-carboxamide
CID 67239407
N-(4-morpholin-2-ylphenyl)-2-phenyl-1,3-thiazole-4-carboxamide;N-(4-morpholin-2-ylphenyl)-2-phenyl-1,3-thiazole-5-carboxamide;N-[4-[(3S)-piperidin-3-yl]phenyl]-3-(trifluoromethyl)benzamide
CID 159882476
4-methyl-N-(4-morpholin-2-ylphenyl)-2-pyrazin-2-yl-1,3-thiazole-5-carboxamide;hydrochloride
CID 67239406
N-(4-morpholin-2-ylphenyl)-2-pyrazin-2-yl-1,3-thiazole-4-carboxamide;hydrochloride
CID 67239626
N-[4-[(2R)-morpholin-2-yl]phenyl]-2-pyrazin-2-yl-1,3-thiazole-4-carboxamide
CID 124566210
methyl 6-(3-piperidin-1-ylpropylcarbamoyl)pyridine-2-carboxylate;methyl 6-(3-piperidin-1-ylpropylcarbamoyl)pyridine-3-carboxylate;N-(3-piperidin-1-ylpropyl)-1,3-benzothiazole-6-carboxamide;N-(3-piperidin-1-ylpropyl)-4-pyridin-4-ylbenzamide
CID 157985006
4-methyl-N-[4-[(2R)-morpholin-2-yl]phenyl]-2-pyrazin-2-yl-1,3-thiazole-5-carboxamide;hydrochloride
CID 175718304
5-[6-[(2S)-4-(2,4-dimethyl-1,3-thiazole-5-carbonyl)morpholin-2-yl]-3-pyridinyl]-N-methylpyridine-2-carboxamide
CID 124367701
5-[6-[(2R)-4-(2,4-dimethyl-1,3-thiazole-5-carbonyl)morpholin-2-yl]-3-pyridinyl]-N-methylpyridine-2-carboxamide
CID 124367702
N-[4-[(2S)-morpholin-2-yl]phenyl]-2-pyrazin-2-yl-1,3-thiazole-4-carboxamide
CID 124566211
N-methyl-5-[2-methyl-6-[(2S)-4-(4-methyl-1,3-thiazole-5-carbonyl)morpholin-2-yl]-4-pyridinyl]pyridine-2-carboxamide
CID 124951336

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-N-[4-[(3S)-piperidin-3-yl]phenyl]pyridine-3-carboxamide;N-(4-morpholin-2-ylphenyl)-2-pyrazin-2-yl-1,3-thiazole-4-carboxamide;N-[4-[(3S)-piperidin-3-yl]phenyl]-6-propylpyridine-3-carboxamide?
The IUPAC name of 6-ethyl-N-[4-[(3S)-piperidin-3-yl]phenyl]pyridine-3-carboxamide;N-(4-morpholin-2-ylphenyl)-2-pyrazin-2-yl-1,3-thiazole-4-carboxamide;N-[4-[(3S)-piperidin-3-yl]phenyl]-6-propylpyridine-3-carboxamide (CID 162038188) is 6-ethyl-N-[4-[(3S)-piperidin-3-yl]phenyl]pyridine-3-carboxamide;N-(4-morpholin-2-ylphenyl)-2-pyrazin-2-yl-1,3-thiazole-4-carboxamide;N-[4-[(3S)-piperidin-3-yl]phenyl]-6-propylpyridine-3-carboxamide.
What is the SMILES notation for 6-ethyl-N-[4-[(3S)-piperidin-3-yl]phenyl]pyridine-3-carboxamide;N-(4-morpholin-2-ylphenyl)-2-pyrazin-2-yl-1,3-thiazole-4-carboxamide;N-[4-[(3S)-piperidin-3-yl]phenyl]-6-propylpyridine-3-carboxamide?
The canonical SMILES for 6-ethyl-N-[4-[(3S)-piperidin-3-yl]phenyl]pyridine-3-carboxamide;N-(4-morpholin-2-ylphenyl)-2-pyrazin-2-yl-1,3-thiazole-4-carboxamide;N-[4-[(3S)-piperidin-3-yl]phenyl]-6-propylpyridine-3-carboxamide is CCCc1ccc(C(=O)Nc2ccc([C@@H]3CCCNC3)cc2)cn1.CCc1ccc(C(=O)Nc2ccc([C@@H]3CCCNC3)cc2)cn1.O=C(Nc1ccc(C2CNCCO2)cc1)c1csc(-c2cnccn2)n1.
What is the InChIKey of 6-ethyl-N-[4-[(3S)-piperidin-3-yl]phenyl]pyridine-3-carboxamide;N-(4-morpholin-2-ylphenyl)-2-pyrazin-2-yl-1,3-thiazole-4-carboxamide;N-[4-[(3S)-piperidin-3-yl]phenyl]-6-propylpyridine-3-carboxamide?
The InChIKey is YWXRAMZPYXCENW-UKYNRDOCSA-N. The full InChI is InChI=1S/C20H25N3O.C19H23N3O.C18H17N5O2S/c1-2-4-18-9-8-17(14-22-18)20(24)23-19-10-6-15(7-11-19)16-5-3-12-21-13-16;1-2-17-8-7-16(13-21-17)19(23)22-18-9-5-14(6-10-18)15-4-3-11-20-12-15;24-17(15-11-26-18(23-15)14-9-19-5-6-21-14)22-13-3-1-12(2-4-13)16-10-20-7-8-25-16/h6-11,14,16,21H,2-5,12-13H2,1H3,(H,23,24);5-10,13,15,20H,2-4,11-12H2,1H3,(H,22,23);1-6,9,11,16,20H,7-8,10H2,(H,22,24)/t16-;15-;/m11./s1.
What are the key properties of 6-ethyl-N-[4-[(3S)-piperidin-3-yl]phenyl]pyridine-3-carboxamide;N-(4-morpholin-2-ylphenyl)-2-pyrazin-2-yl-1,3-thiazole-4-carboxamide;N-[4-[(3S)-piperidin-3-yl]phenyl]-6-propylpyridine-3-carboxamide?
6-ethyl-N-[4-[(3S)-piperidin-3-yl]phenyl]pyridine-3-carboxamide;N-(4-morpholin-2-ylphenyl)-2-pyrazin-2-yl-1,3-thiazole-4-carboxamide;N-[4-[(3S)-piperidin-3-yl]phenyl]-6-propylpyridine-3-carboxamide has a molecular weight of 1000.29 g/mol, XLogP of 9.63, 13 rotatable bonds, 6 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-N-[4-[(3S)-piperidin-3-yl]phenyl]pyridine-3-carboxamide;N-(4-morpholin-2-ylphenyl)-2-pyrazin-2-yl-1,3-thiazole-4-carboxamide;N-[4-[(3S)-piperidin-3-yl]phenyl]-6-propylpyridine-3-carboxamide is sourced from PubChem (CID 162038188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).