3-[(3-methoxypyridine-4-carbonyl)amino]cyclopentane-1-carboxylic acid

C13H16N2O4 — CID 105063233

IUPAC3-[(3-methoxypyridine-4-carbonyl)amino]cyclopentane-1-carboxylic acid
SMILESCOc1cnccc1C(=O)NC1CCC(C(=O)O)C1
InChIInChI=1S/C13H16N2O4/c1-19-11-7-14-5-4-10(11)12(16)15-9-3-2-8(6-9)13(17)18/h4-5,7-9H,2-3,6H2,1H3,(H,15,16)(H,17,18)
InChIKeyCANWWTQIENSWGW-UHFFFAOYSA-N
MW264.28 g/mol
LogP1.07
Rot. Bonds4

About 3-[(3-methoxypyridine-4-carbonyl)amino]cyclopentane-1-carboxylic acid

3-[(3-methoxypyridine-4-carbonyl)amino]cyclopentane-1-carboxylic acid (PubChem CID 105063233) has the molecular formula C13H16N2O4 and a molecular weight of 264.28 g/mol. Its IUPAC name is 3-[(3-methoxypyridine-4-carbonyl)amino]cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name3-[(3-methoxypyridine-4-carbonyl)amino]cyclopentane-1-carboxylic acid
PubChem CID105063233
Molecular FormulaC13H16N2O4
Molecular Weight264.28 g/mol
Exact Mass264.11
IUPAC Name3-[(3-methoxypyridine-4-carbonyl)amino]cyclopentane-1-carboxylic acid
SMILESCOc1cnccc1C(=O)NC1CCC(C(=O)O)C1
InChIInChI=1S/C13H16N2O4/c1-19-11-7-14-5-4-10(11)12(16)15-9-3-2-8(6-9)13(17)18/h4-5,7-9H,2-3,6H2,1H3,(H,15,16)(H,17,18)
InChIKeyCANWWTQIENSWGW-UHFFFAOYSA-N
XLogP1.07
TPSA88.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.28
LogP ≤ 51.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-methoxy-N-[4-(methylamino)cyclohexyl]pyridine-4-carboxamide
CID 105063330
N-(4-bromocyclohexyl)-3-methoxypyridine-4-carboxamide
CID 105064552
cis-(1R,3S)-3-[(5-fluoro-2-methoxybenzoyl)amino]cyclopentane-1-carboxylic acid
CID 120679011
cis-(1R,3S)-3-[(2-fluoro-4,5-dimethoxybenzoyl)amino]cyclopentane-1-carboxylic acid
CID 120677489
N-[(1R,2R)-2-hydroxycyclohexyl]-3-methoxypyridine-4-carboxamide
CID 102739207
2-[[(3-methoxypyridine-4-carbonyl)amino]methyl]cyclopentane-1-carboxylic acid
CID 105063230
3-[(3-fluoropyridine-4-carbonyl)amino]cyclohexane-1-carboxylic acid
CID 64951456
N-(2-bromocyclopentyl)-3-methoxypyridine-4-carboxamide
CID 105063711
4-[(5-methoxy-2-methylpyridine-4-carbonyl)amino]cyclohexane-1-carboxylic acid
CID 157011651
cis-(1R,3S)-3-[(2-methoxy-5-sulfamoylbenzoyl)amino]cyclopentane-1-carboxylic acid
CID 120678871
cis-(1S,3R)-3-[(2-fluoro-6-methoxybenzoyl)amino]cyclopentane-1-carboxylic acid
CID 120675723
cis-(1S,3R)-3-[(2-ethoxybenzoyl)amino]cyclopentane-1-carboxylic acid
CID 120677160

Frequently Asked Questions

What is the IUPAC name of 3-[(3-methoxypyridine-4-carbonyl)amino]cyclopentane-1-carboxylic acid?
The IUPAC name of 3-[(3-methoxypyridine-4-carbonyl)amino]cyclopentane-1-carboxylic acid (CID 105063233) is 3-[(3-methoxypyridine-4-carbonyl)amino]cyclopentane-1-carboxylic acid.
What is the SMILES notation for 3-[(3-methoxypyridine-4-carbonyl)amino]cyclopentane-1-carboxylic acid?
The canonical SMILES for 3-[(3-methoxypyridine-4-carbonyl)amino]cyclopentane-1-carboxylic acid is COc1cnccc1C(=O)NC1CCC(C(=O)O)C1.
What is the InChIKey of 3-[(3-methoxypyridine-4-carbonyl)amino]cyclopentane-1-carboxylic acid?
The InChIKey is CANWWTQIENSWGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O4/c1-19-11-7-14-5-4-10(11)12(16)15-9-3-2-8(6-9)13(17)18/h4-5,7-9H,2-3,6H2,1H3,(H,15,16)(H,17,18).
What are the key properties of 3-[(3-methoxypyridine-4-carbonyl)amino]cyclopentane-1-carboxylic acid?
3-[(3-methoxypyridine-4-carbonyl)amino]cyclopentane-1-carboxylic acid has a molecular weight of 264.28 g/mol, XLogP of 1.07, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3-methoxypyridine-4-carbonyl)amino]cyclopentane-1-carboxylic acid is sourced from PubChem (CID 105063233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).