2-[1-[(3-methylpyridine-2-carbonyl)amino]cyclopentyl]acetic acid

C14H18N2O3 — CID 64671017

IUPAC2-[1-[(3-methylpyridine-2-carbonyl)amino]cyclopentyl]acetic acid
SMILESCc1cccnc1C(=O)NC1(CC(=O)O)CCCC1
InChIInChI=1S/C14H18N2O3/c1-10-5-4-8-15-12(10)13(19)16-14(9-11(17)18)6-2-3-7-14/h4-5,8H,2-3,6-7,9H2,1H3,(H,16,19)(H,17,18)
InChIKeyPDFXPFZJXPMVBN-UHFFFAOYSA-N
MW262.31 g/mol
LogP1.91
Rot. Bonds4

About 2-[1-[(3-methylpyridine-2-carbonyl)amino]cyclopentyl]acetic acid

2-[1-[(3-methylpyridine-2-carbonyl)amino]cyclopentyl]acetic acid (PubChem CID 64671017) has the molecular formula C14H18N2O3 and a molecular weight of 262.31 g/mol. Its IUPAC name is 2-[1-[(3-methylpyridine-2-carbonyl)amino]cyclopentyl]acetic acid.

Molecular Properties

Compound Name2-[1-[(3-methylpyridine-2-carbonyl)amino]cyclopentyl]acetic acid
PubChem CID64671017
Molecular FormulaC14H18N2O3
Molecular Weight262.31 g/mol
Exact Mass262.13
IUPAC Name2-[1-[(3-methylpyridine-2-carbonyl)amino]cyclopentyl]acetic acid
SMILESCc1cccnc1C(=O)NC1(CC(=O)O)CCCC1
InChIInChI=1S/C14H18N2O3/c1-10-5-4-8-15-12(10)13(19)16-14(9-11(17)18)6-2-3-7-14/h4-5,8H,2-3,6-7,9H2,1H3,(H,16,19)(H,17,18)
InChIKeyPDFXPFZJXPMVBN-UHFFFAOYSA-N
XLogP1.91
TPSA79.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.31
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(hydroxymethyl)cyclopropyl]-3-methylpyridine-2-carboxamide
CID 115877759
1-[(3-methylpyridine-2-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 62338755
3-hydroxy-N-[1-(hydroxymethyl)cyclopentyl]pyridine-2-carboxamide
CID 55081325
N-(1-cyanocyclopentyl)-3-methylpyridine-2-carboxamide
CID 55059760
N-[4-(chloromethyl)oxan-4-yl]-3-methylpyridine-2-carboxamide
CID 114170454
ethane;N-(4-ethylpiperidin-4-yl)-3-methylpyridine-2-carboxamide
CID 162725478
2-[1-[[2-(2-methylphenyl)acetyl]amino]cyclopentyl]acetic acid
CID 64670407
2-[1-[(2-methoxypyridine-3-carbonyl)amino]cyclobutyl]acetic acid
CID 79848236
N-(1-carbamothioylcyclooctyl)-3-methylpyridine-2-carboxamide
CID 62340478
3-amino-N-[1-(hydroxymethyl)cyclohexyl]pyridine-2-carboxamide
CID 113447709
N-[(1-aminocyclohexyl)methyl]-3-methylpyridine-2-carboxamide
CID 119404249
2-[[1-(hydroxymethyl)cyclohexyl]carbamoyl]pyridine-3-carboxylic acid
CID 63614286

Frequently Asked Questions

What is the IUPAC name of 2-[1-[(3-methylpyridine-2-carbonyl)amino]cyclopentyl]acetic acid?
The IUPAC name of 2-[1-[(3-methylpyridine-2-carbonyl)amino]cyclopentyl]acetic acid (CID 64671017) is 2-[1-[(3-methylpyridine-2-carbonyl)amino]cyclopentyl]acetic acid.
What is the SMILES notation for 2-[1-[(3-methylpyridine-2-carbonyl)amino]cyclopentyl]acetic acid?
The canonical SMILES for 2-[1-[(3-methylpyridine-2-carbonyl)amino]cyclopentyl]acetic acid is Cc1cccnc1C(=O)NC1(CC(=O)O)CCCC1.
What is the InChIKey of 2-[1-[(3-methylpyridine-2-carbonyl)amino]cyclopentyl]acetic acid?
The InChIKey is PDFXPFZJXPMVBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O3/c1-10-5-4-8-15-12(10)13(19)16-14(9-11(17)18)6-2-3-7-14/h4-5,8H,2-3,6-7,9H2,1H3,(H,16,19)(H,17,18).
What are the key properties of 2-[1-[(3-methylpyridine-2-carbonyl)amino]cyclopentyl]acetic acid?
2-[1-[(3-methylpyridine-2-carbonyl)amino]cyclopentyl]acetic acid has a molecular weight of 262.31 g/mol, XLogP of 1.91, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[(3-methylpyridine-2-carbonyl)amino]cyclopentyl]acetic acid is sourced from PubChem (CID 64671017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).