(3S)-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]piperidine-3-carboxamide

C15H19N5O — CID 81119624

IUPAC(3S)-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]piperidine-3-carboxamide
SMILESCc1nccn1-c1ncccc1NC(=O)[C@H]1CCCNC1
InChIInChI=1S/C15H19N5O/c1-11-17-8-9-20(11)14-13(5-3-7-18-14)19-15(21)12-4-2-6-16-10-12/h3,5,7-9,12,16H,2,4,6,10H2,1H3,(H,19,21)/t12-/m0/s1
InChIKeyRBWBSVKRTXAATC-LBPRGKRZSA-N
MW285.35 g/mol
LogP1.51
Rot. Bonds3

About (3S)-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]piperidine-3-carboxamide

(3S)-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]piperidine-3-carboxamide (PubChem CID 81119624) has the molecular formula C15H19N5O and a molecular weight of 285.35 g/mol. Its IUPAC name is (3S)-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]piperidine-3-carboxamide.

Molecular Properties

Compound Name(3S)-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]piperidine-3-carboxamide
PubChem CID81119624
Molecular FormulaC15H19N5O
Molecular Weight285.35 g/mol
Exact Mass285.16
IUPAC Name(3S)-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]piperidine-3-carboxamide
SMILESCc1nccn1-c1ncccc1NC(=O)[C@H]1CCCNC1
InChIInChI=1S/C15H19N5O/c1-11-17-8-9-20(11)14-13(5-3-7-18-14)19-15(21)12-4-2-6-16-10-12/h3,5,7-9,12,16H,2,4,6,10H2,1H3,(H,19,21)/t12-/m0/s1
InChIKeyRBWBSVKRTXAATC-LBPRGKRZSA-N
XLogP1.51
TPSA71.84 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 51.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze (3S)-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]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

N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]-3-piperidin-3-ylbutanamide
CID 119847742
N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]acetamide
CID 47254863
2-(cyclopropylamino)-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]acetamide
CID 60927836
trans-(1S,2S)-2-(furan-2-yl)-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]cyclopropane-1-carboxamide
CID 94817860
N-(2-methyl-3-pyridinyl)azetidine-3-carboxamide
CID 79044396
N-[2-(3-methylpyrazol-1-yl)phenyl]piperidine-3-carboxamide
CID 119341252
N-[2-(4-methyl-1,2,4-triazol-3-yl)phenyl]piperidine-3-carboxamide
CID 43706685
N-cyclopropyl-2-(2-methylimidazol-1-yl)pyridin-3-amine
CID 103439170
(3R)-N-(2,6-dimethyl-3-pyridinyl)piperidine-3-carboxamide
CID 81133991
(3S)-N-(2-imidazol-1-ylphenyl)piperidine-3-carboxamide
CID 81123663
(3R)-N-(3-chloro-2-imidazol-1-ylphenyl)piperidine-3-carboxamide
CID 81119583
N-(1-benzylimidazol-2-yl)piperidine-3-carboxamide
CID 119297675

Frequently Asked Questions

What is the IUPAC name of (3S)-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]piperidine-3-carboxamide?
The IUPAC name of (3S)-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]piperidine-3-carboxamide (CID 81119624) is (3S)-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]piperidine-3-carboxamide.
What is the SMILES notation for (3S)-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]piperidine-3-carboxamide?
The canonical SMILES for (3S)-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]piperidine-3-carboxamide is Cc1nccn1-c1ncccc1NC(=O)[C@H]1CCCNC1.
What is the InChIKey of (3S)-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]piperidine-3-carboxamide?
The InChIKey is RBWBSVKRTXAATC-LBPRGKRZSA-N. The full InChI is InChI=1S/C15H19N5O/c1-11-17-8-9-20(11)14-13(5-3-7-18-14)19-15(21)12-4-2-6-16-10-12/h3,5,7-9,12,16H,2,4,6,10H2,1H3,(H,19,21)/t12-/m0/s1.
What are the key properties of (3S)-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]piperidine-3-carboxamide?
(3S)-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]piperidine-3-carboxamide has a molecular weight of 285.35 g/mol, XLogP of 1.51, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]piperidine-3-carboxamide is sourced from PubChem (CID 81119624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).