1-acetyl-N-[(2-methoxy-3-pyridinyl)methyl]piperidine-4-carboxamide

C15H21N3O3 — CID 38533454

IUPAC1-acetyl-N-[(2-methoxy-3-pyridinyl)methyl]piperidine-4-carboxamide
SMILESCOc1ncccc1CNC(=O)C1CCN(C(C)=O)CC1
InChIInChI=1S/C15H21N3O3/c1-11(19)18-8-5-12(6-9-18)14(20)17-10-13-4-3-7-16-15(13)21-2/h3-4,7,12H,5-6,8-10H2,1-2H3,(H,17,20)
InChIKeyWCNSAPWITPEABK-UHFFFAOYSA-N
MW291.35 g/mol
LogP0.96
Rot. Bonds4

About 1-acetyl-N-[(2-methoxy-3-pyridinyl)methyl]piperidine-4-carboxamide

1-acetyl-N-[(2-methoxy-3-pyridinyl)methyl]piperidine-4-carboxamide (PubChem CID 38533454) has the molecular formula C15H21N3O3 and a molecular weight of 291.35 g/mol. Its IUPAC name is 1-acetyl-N-[(2-methoxy-3-pyridinyl)methyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-acetyl-N-[(2-methoxy-3-pyridinyl)methyl]piperidine-4-carboxamide
PubChem CID38533454
Molecular FormulaC15H21N3O3
Molecular Weight291.35 g/mol
Exact Mass291.16
IUPAC Name1-acetyl-N-[(2-methoxy-3-pyridinyl)methyl]piperidine-4-carboxamide
SMILESCOc1ncccc1CNC(=O)C1CCN(C(C)=O)CC1
InChIInChI=1S/C15H21N3O3/c1-11(19)18-8-5-12(6-9-18)14(20)17-10-13-4-3-7-16-15(13)21-2/h3-4,7,12H,5-6,8-10H2,1-2H3,(H,17,20)
InChIKeyWCNSAPWITPEABK-UHFFFAOYSA-N
XLogP0.96
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-acetyl-N-[(2-methoxy-3-pyridinyl)methyl]piperidine-4-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

1-(4-fluorobenzoyl)-N-[(2-methoxy-3-pyridinyl)methyl]piperidine-4-carboxamide
CID 38533214
1-[4-[(2-methoxy-3-pyridinyl)methylamino]piperidin-1-yl]ethanone
CID 60762093
N-[(2-methoxy-3-pyridinyl)methyl]-1-pyridin-3-ylsulfonylpiperidine-4-carboxamide
CID 30902248
N-[(2-methoxy-3-pyridinyl)methyl]-1,1-dioxothiolane-3-carboxamide
CID 47160065
(3S)-N-[(2-methoxy-3-pyridinyl)methyl]piperidine-3-carboxamide
CID 81124657
2-amino-N-[(2-methoxy-3-pyridinyl)methyl]cyclopentane-1-carboxamide
CID 64824935
1-[2-(2-methoxy-3-pyridinyl)ethylcarbamoyl]piperidine-4-carboxylic acid
CID 122014852
N-[(2-methoxy-3-pyridinyl)methyl]-1-propylsulfonylpiperidine-2-carboxamide
CID 55966193
1-(azepan-1-yl)-2-[(2-methoxy-3-pyridinyl)methylamino]ethanone
CID 60859816
4-(4-acetylpiperazin-1-yl)sulfonyl-N-[(2-methoxy-3-pyridinyl)methyl]benzamide
CID 38534496
1-acetyl-N-[(2-methoxy-5-methylphenyl)methyl]piperidine-4-carboxamide
CID 32858300
1-acetyl-N-[(5-fluoro-2-methoxyphenyl)methyl]piperidine-4-carboxamide
CID 110793478

Frequently Asked Questions

What is the IUPAC name of 1-acetyl-N-[(2-methoxy-3-pyridinyl)methyl]piperidine-4-carboxamide?
The IUPAC name of 1-acetyl-N-[(2-methoxy-3-pyridinyl)methyl]piperidine-4-carboxamide (CID 38533454) is 1-acetyl-N-[(2-methoxy-3-pyridinyl)methyl]piperidine-4-carboxamide.
What is the SMILES notation for 1-acetyl-N-[(2-methoxy-3-pyridinyl)methyl]piperidine-4-carboxamide?
The canonical SMILES for 1-acetyl-N-[(2-methoxy-3-pyridinyl)methyl]piperidine-4-carboxamide is COc1ncccc1CNC(=O)C1CCN(C(C)=O)CC1.
What is the InChIKey of 1-acetyl-N-[(2-methoxy-3-pyridinyl)methyl]piperidine-4-carboxamide?
The InChIKey is WCNSAPWITPEABK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O3/c1-11(19)18-8-5-12(6-9-18)14(20)17-10-13-4-3-7-16-15(13)21-2/h3-4,7,12H,5-6,8-10H2,1-2H3,(H,17,20).
What are the key properties of 1-acetyl-N-[(2-methoxy-3-pyridinyl)methyl]piperidine-4-carboxamide?
1-acetyl-N-[(2-methoxy-3-pyridinyl)methyl]piperidine-4-carboxamide has a molecular weight of 291.35 g/mol, XLogP of 0.96, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-acetyl-N-[(2-methoxy-3-pyridinyl)methyl]piperidine-4-carboxamide is sourced from PubChem (CID 38533454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).