1-acetyl-N-ethyl-N-(pyridin-4-ylmethyl)piperidine-2-carboxamide

C16H23N3O2 — CID 146086260

IUPAC1-acetyl-N-ethyl-N-(pyridin-4-ylmethyl)piperidine-2-carboxamide
SMILESCCN(Cc1ccncc1)C(=O)C1CCCCN1C(C)=O
InChIInChI=1S/C16H23N3O2/c1-3-18(12-14-7-9-17-10-8-14)16(21)15-6-4-5-11-19(15)13(2)20/h7-10,15H,3-6,11-12H2,1-2H3
InChIKeyZODDITWUTGNAML-UHFFFAOYSA-N
MW289.38 g/mol
LogP1.83
Rot. Bonds4

About 1-acetyl-N-ethyl-N-(pyridin-4-ylmethyl)piperidine-2-carboxamide

1-acetyl-N-ethyl-N-(pyridin-4-ylmethyl)piperidine-2-carboxamide (PubChem CID 146086260) has the molecular formula C16H23N3O2 and a molecular weight of 289.38 g/mol. Its IUPAC name is 1-acetyl-N-ethyl-N-(pyridin-4-ylmethyl)piperidine-2-carboxamide.

Molecular Properties

Compound Name1-acetyl-N-ethyl-N-(pyridin-4-ylmethyl)piperidine-2-carboxamide
PubChem CID146086260
Molecular FormulaC16H23N3O2
Molecular Weight289.38 g/mol
Exact Mass289.18
IUPAC Name1-acetyl-N-ethyl-N-(pyridin-4-ylmethyl)piperidine-2-carboxamide
SMILESCCN(Cc1ccncc1)C(=O)C1CCCCN1C(C)=O
InChIInChI=1S/C16H23N3O2/c1-3-18(12-14-7-9-17-10-8-14)16(21)15-6-4-5-11-19(15)13(2)20/h7-10,15H,3-6,11-12H2,1-2H3
InChIKeyZODDITWUTGNAML-UHFFFAOYSA-N
XLogP1.83
TPSA53.51 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 51.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1-acetyl-N-ethyl-N-(pyridin-4-ylmethyl)piperidine-2-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

(2S)-1-[ethyl(pyridin-4-ylmethyl)carbamoyl]pyrrolidine-2-carboxylic acid
CID 61449819
(2R)-N,N-diethyl-1-(pyridine-4-carbonyl)pyrrolidine-2-carboxamide
CID 95196009
1-acetyl-N-(3-aminopropyl)-N-benzylpyrrolidine-2-carboxamide
CID 120649215
(2S)-N-ethyl-N-(pyridin-4-ylmethyl)piperidine-2-carboxamide
CID 93375227
tert-butyl (2S)-2-[(4-bromophenyl)methyl-ethylcarbamoyl]piperidine-1-carboxylate
CID 97177305
N-ethyl-N-(pyridin-4-ylmethyl)piperidine-3-carboxamide
CID 54873767
(3R)-1-cyclopentyl-N-ethyl-6-oxo-N-(pyridin-4-ylmethyl)piperidine-3-carboxamide
CID 25275185
(2R)-N-ethyl-N-(pyridin-4-ylmethyl)pyrrolidine-2-carboxamide
CID 93375226
1-[benzyl(ethyl)carbamoyl]piperidine-2-carboxylic acid
CID 61185364
tert-butyl 2-[(3,4-dichlorophenyl)methyl-ethylcarbamoyl]piperidine-1-carboxylate
CID 71635198
(2S)-N-methyl-1-[(2R)-oxolane-2-carbonyl]-N-(pyridin-4-ylmethyl)piperidine-2-carboxamide
CID 124546406
(2S)-N-methyl-1-[(2S)-oxolane-2-carbonyl]-N-(pyridin-4-ylmethyl)piperidine-2-carboxamide
CID 124546404

Frequently Asked Questions

What is the IUPAC name of 1-acetyl-N-ethyl-N-(pyridin-4-ylmethyl)piperidine-2-carboxamide?
The IUPAC name of 1-acetyl-N-ethyl-N-(pyridin-4-ylmethyl)piperidine-2-carboxamide (CID 146086260) is 1-acetyl-N-ethyl-N-(pyridin-4-ylmethyl)piperidine-2-carboxamide.
What is the SMILES notation for 1-acetyl-N-ethyl-N-(pyridin-4-ylmethyl)piperidine-2-carboxamide?
The canonical SMILES for 1-acetyl-N-ethyl-N-(pyridin-4-ylmethyl)piperidine-2-carboxamide is CCN(Cc1ccncc1)C(=O)C1CCCCN1C(C)=O.
What is the InChIKey of 1-acetyl-N-ethyl-N-(pyridin-4-ylmethyl)piperidine-2-carboxamide?
The InChIKey is ZODDITWUTGNAML-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O2/c1-3-18(12-14-7-9-17-10-8-14)16(21)15-6-4-5-11-19(15)13(2)20/h7-10,15H,3-6,11-12H2,1-2H3.
What are the key properties of 1-acetyl-N-ethyl-N-(pyridin-4-ylmethyl)piperidine-2-carboxamide?
1-acetyl-N-ethyl-N-(pyridin-4-ylmethyl)piperidine-2-carboxamide has a molecular weight of 289.38 g/mol, XLogP of 1.83, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-acetyl-N-ethyl-N-(pyridin-4-ylmethyl)piperidine-2-carboxamide is sourced from PubChem (CID 146086260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).