(3S)-3-hydroxy-1-[5-(3-methylphenyl)pyridine-3-carbonyl]piperidine-3-carboxamide

C19H21N3O3 — CID 129485829

IUPAC(3S)-3-hydroxy-1-[5-(3-methylphenyl)pyridine-3-carbonyl]piperidine-3-carboxamide
SMILESCc1cccc(-c2cncc(C(=O)N3CCC[C@@](O)(C(N)=O)C3)c2)c1
InChIInChI=1S/C19H21N3O3/c1-13-4-2-5-14(8-13)15-9-16(11-21-10-15)17(23)22-7-3-6-19(25,12-22)18(20)24/h2,4-5,8-11,25H,3,6-7,12H2,1H3,(H2,20,24)/t19-/m0/s1
InChIKeyMMXBMELFKAVGNG-IBGZPJMESA-N
MW339.40 g/mol
LogP1.51
Rot. Bonds3

About (3S)-3-hydroxy-1-[5-(3-methylphenyl)pyridine-3-carbonyl]piperidine-3-carboxamide

(3S)-3-hydroxy-1-[5-(3-methylphenyl)pyridine-3-carbonyl]piperidine-3-carboxamide (PubChem CID 129485829) has the molecular formula C19H21N3O3 and a molecular weight of 339.40 g/mol. Its IUPAC name is (3S)-3-hydroxy-1-[5-(3-methylphenyl)pyridine-3-carbonyl]piperidine-3-carboxamide.

Molecular Properties

Compound Name(3S)-3-hydroxy-1-[5-(3-methylphenyl)pyridine-3-carbonyl]piperidine-3-carboxamide
PubChem CID129485829
Molecular FormulaC19H21N3O3
Molecular Weight339.40 g/mol
Exact Mass339.16
IUPAC Name(3S)-3-hydroxy-1-[5-(3-methylphenyl)pyridine-3-carbonyl]piperidine-3-carboxamide
SMILESCc1cccc(-c2cncc(C(=O)N3CCC[C@@](O)(C(N)=O)C3)c2)c1
InChIInChI=1S/C19H21N3O3/c1-13-4-2-5-14(8-13)15-9-16(11-21-10-15)17(23)22-7-3-6-19(25,12-22)18(20)24/h2,4-5,8-11,25H,3,6-7,12H2,1H3,(H2,20,24)/t19-/m0/s1
InChIKeyMMXBMELFKAVGNG-IBGZPJMESA-N
XLogP1.51
TPSA96.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.40
LogP ≤ 51.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze (3S)-3-hydroxy-1-[5-(3-methylphenyl)pyridine-3-carbonyl]piperidine-3-carboxamide 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

(3S)-3-hydroxy-1-(4-phenylbenzoyl)piperidine-3-carboxamide
CID 100651742
3-[1-[5-(3-methylphenyl)pyridine-3-carbonyl]piperidin-3-yl]propanoic acid
CID 120536454
(3S)-1-(3-bromo-5-methylbenzoyl)-3-hydroxypiperidine-3-carboxamide
CID 100652020
3-hydroxy-1-(5-methylfuran-3-carbonyl)piperidine-3-carboxamide
CID 128964564
(3S)-1-(2-bromo-4-methylbenzoyl)-3-hydroxypiperidine-3-carboxamide
CID 129353762
1-(4-chloro-3-methylbenzoyl)-3-hydroxypiperidine-3-carboxamide
CID 128964411
[5-[4-(3-methylphenyl)piperazin-1-yl]-3-pyridinyl]-piperidin-1-ylmethanone
CID 109226310
(4-amino-3,3-dimethylpiperidin-1-yl)-(5-phenyl-3-pyridinyl)methanone
CID 120818980
(3S)-1-(3-chloropyridine-4-carbonyl)-3-hydroxypiperidine-3-carboxamide
CID 129485786
1-(4-chloro-2-methylbenzoyl)-3-hydroxypiperidine-3-carboxamide
CID 128964687
1-(3-chloropyridine-4-carbonyl)-3-hydroxypiperidine-3-carboxamide
CID 128964613
(3R)-1-(2-chloro-4,5-dimethylbenzoyl)-3-hydroxypiperidine-3-carboxamide
CID 129491751

Frequently Asked Questions

What is the IUPAC name of (3S)-3-hydroxy-1-[5-(3-methylphenyl)pyridine-3-carbonyl]piperidine-3-carboxamide?
The IUPAC name of (3S)-3-hydroxy-1-[5-(3-methylphenyl)pyridine-3-carbonyl]piperidine-3-carboxamide (CID 129485829) is (3S)-3-hydroxy-1-[5-(3-methylphenyl)pyridine-3-carbonyl]piperidine-3-carboxamide.
What is the SMILES notation for (3S)-3-hydroxy-1-[5-(3-methylphenyl)pyridine-3-carbonyl]piperidine-3-carboxamide?
The canonical SMILES for (3S)-3-hydroxy-1-[5-(3-methylphenyl)pyridine-3-carbonyl]piperidine-3-carboxamide is Cc1cccc(-c2cncc(C(=O)N3CCC[C@@](O)(C(N)=O)C3)c2)c1.
What is the InChIKey of (3S)-3-hydroxy-1-[5-(3-methylphenyl)pyridine-3-carbonyl]piperidine-3-carboxamide?
The InChIKey is MMXBMELFKAVGNG-IBGZPJMESA-N. The full InChI is InChI=1S/C19H21N3O3/c1-13-4-2-5-14(8-13)15-9-16(11-21-10-15)17(23)22-7-3-6-19(25,12-22)18(20)24/h2,4-5,8-11,25H,3,6-7,12H2,1H3,(H2,20,24)/t19-/m0/s1.
What are the key properties of (3S)-3-hydroxy-1-[5-(3-methylphenyl)pyridine-3-carbonyl]piperidine-3-carboxamide?
(3S)-3-hydroxy-1-[5-(3-methylphenyl)pyridine-3-carbonyl]piperidine-3-carboxamide has a molecular weight of 339.40 g/mol, XLogP of 1.51, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-3-hydroxy-1-[5-(3-methylphenyl)pyridine-3-carbonyl]piperidine-3-carboxamide is sourced from PubChem (CID 129485829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).