N-(4-aminocyclohexyl)-N-ethyl-2-oxo-1H-pyridine-3-carboxamide

C14H21N3O2 — CID 79116433

IUPACN-(4-aminocyclohexyl)-N-ethyl-2-oxo-1H-pyridine-3-carboxamide
SMILESCCN(C(=O)c1ccc[nH]c1=O)C1CCC(N)CC1
InChIInChI=1S/C14H21N3O2/c1-2-17(11-7-5-10(15)6-8-11)14(19)12-4-3-9-16-13(12)18/h3-4,9-11H,2,5-8,15H2,1H3,(H,16,18)
InChIKeyYWGDWBBILKQZNA-UHFFFAOYSA-N
MW263.34 g/mol
LogP1.11
Rot. Bonds3

About N-(4-aminocyclohexyl)-N-ethyl-2-oxo-1H-pyridine-3-carboxamide

N-(4-aminocyclohexyl)-N-ethyl-2-oxo-1H-pyridine-3-carboxamide (PubChem CID 79116433) has the molecular formula C14H21N3O2 and a molecular weight of 263.34 g/mol. Its IUPAC name is N-(4-aminocyclohexyl)-N-ethyl-2-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(4-aminocyclohexyl)-N-ethyl-2-oxo-1H-pyridine-3-carboxamide
PubChem CID79116433
Molecular FormulaC14H21N3O2
Molecular Weight263.34 g/mol
Exact Mass263.16
IUPAC NameN-(4-aminocyclohexyl)-N-ethyl-2-oxo-1H-pyridine-3-carboxamide
SMILESCCN(C(=O)c1ccc[nH]c1=O)C1CCC(N)CC1
InChIInChI=1S/C14H21N3O2/c1-2-17(11-7-5-10(15)6-8-11)14(19)12-4-3-9-16-13(12)18/h3-4,9-11H,2,5-8,15H2,1H3,(H,16,18)
InChIKeyYWGDWBBILKQZNA-UHFFFAOYSA-N
XLogP1.11
TPSA79.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 51.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethyl-2-oxo-1H-pyridine-3-carboxamide
CID 61231892
N-ethyl-2-oxo-N-piperidin-3-yl-1H-pyridine-3-carboxamide
CID 63636915
N-cyclopropyl-N-[(4-methylphenyl)methyl]-2-oxo-1H-pyridine-3-carboxamide
CID 32590253
N-(4-aminocyclohexyl)-N-ethylbenzamide
CID 79116189
N-cyclopropyl-2-oxo-N-[[4-(trifluoromethyl)phenyl]methyl]-1H-pyridine-3-carboxamide
CID 25352952
N-(4-aminocyclohexyl)-N-ethyl-2-methylfuran-3-carboxamide
CID 79115766
N-(4-aminocyclohexyl)-N-ethyl-4-hydroxy-2-methylbenzamide
CID 107672163
N-cyclopropyl-N-[[5-[(1R,2R)-2-methylcyclopropyl]furan-2-yl]methyl]-2-oxo-1H-pyridine-3-carboxamide
CID 94450217
N-(4-aminocyclohexyl)-N-ethylpyridine-4-carboxamide
CID 79115334
N-(4-aminocyclohexyl)-N-ethyl-3H-benzimidazole-5-carboxamide
CID 79114771
N-(4-aminocyclohexyl)-2-bromo-4-chloro-N-ethylbenzamide
CID 107990592
2-amino-N-cyclopropyl-N-ethylpyridine-3-carboxamide
CID 62155108

Frequently Asked Questions

What is the IUPAC name of N-(4-aminocyclohexyl)-N-ethyl-2-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-(4-aminocyclohexyl)-N-ethyl-2-oxo-1H-pyridine-3-carboxamide (CID 79116433) is N-(4-aminocyclohexyl)-N-ethyl-2-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-(4-aminocyclohexyl)-N-ethyl-2-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-(4-aminocyclohexyl)-N-ethyl-2-oxo-1H-pyridine-3-carboxamide is CCN(C(=O)c1ccc[nH]c1=O)C1CCC(N)CC1.
What is the InChIKey of N-(4-aminocyclohexyl)-N-ethyl-2-oxo-1H-pyridine-3-carboxamide?
The InChIKey is YWGDWBBILKQZNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O2/c1-2-17(11-7-5-10(15)6-8-11)14(19)12-4-3-9-16-13(12)18/h3-4,9-11H,2,5-8,15H2,1H3,(H,16,18).
What are the key properties of N-(4-aminocyclohexyl)-N-ethyl-2-oxo-1H-pyridine-3-carboxamide?
N-(4-aminocyclohexyl)-N-ethyl-2-oxo-1H-pyridine-3-carboxamide has a molecular weight of 263.34 g/mol, XLogP of 1.11, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-aminocyclohexyl)-N-ethyl-2-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 79116433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).