2-[1-[(1-methyl-2-oxopyridine-4-carbonyl)amino]cyclopentyl]acetic acid

C14H18N2O4 — CID 64673373

IUPAC2-[1-[(1-methyl-2-oxopyridine-4-carbonyl)amino]cyclopentyl]acetic acid
SMILESCn1ccc(C(=O)NC2(CC(=O)O)CCCC2)cc1=O
InChIInChI=1S/C14H18N2O4/c1-16-7-4-10(8-11(16)17)13(20)15-14(9-12(18)19)5-2-3-6-14/h4,7-8H,2-3,5-6,9H2,1H3,(H,15,20)(H,18,19)
InChIKeyRYHQWYGYHNAATA-UHFFFAOYSA-N
MW278.31 g/mol
LogP0.90
Rot. Bonds4

About 2-[1-[(1-methyl-2-oxopyridine-4-carbonyl)amino]cyclopentyl]acetic acid

2-[1-[(1-methyl-2-oxopyridine-4-carbonyl)amino]cyclopentyl]acetic acid (PubChem CID 64673373) has the molecular formula C14H18N2O4 and a molecular weight of 278.31 g/mol. Its IUPAC name is 2-[1-[(1-methyl-2-oxopyridine-4-carbonyl)amino]cyclopentyl]acetic acid.

Molecular Properties

Compound Name2-[1-[(1-methyl-2-oxopyridine-4-carbonyl)amino]cyclopentyl]acetic acid
PubChem CID64673373
Molecular FormulaC14H18N2O4
Molecular Weight278.31 g/mol
Exact Mass278.13
IUPAC Name2-[1-[(1-methyl-2-oxopyridine-4-carbonyl)amino]cyclopentyl]acetic acid
SMILESCn1ccc(C(=O)NC2(CC(=O)O)CCCC2)cc1=O
InChIInChI=1S/C14H18N2O4/c1-16-7-4-10(8-11(16)17)13(20)15-14(9-12(18)19)5-2-3-6-14/h4,7-8H,2-3,5-6,9H2,1H3,(H,15,20)(H,18,19)
InChIKeyRYHQWYGYHNAATA-UHFFFAOYSA-N
XLogP0.90
TPSA88.40 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.31
LogP ≤ 50.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[1-[(1-methyl-2-oxopyridine-4-carbonyl)amino]cyclopentyl]acetic acid?
The IUPAC name of 2-[1-[(1-methyl-2-oxopyridine-4-carbonyl)amino]cyclopentyl]acetic acid (CID 64673373) is 2-[1-[(1-methyl-2-oxopyridine-4-carbonyl)amino]cyclopentyl]acetic acid.
What is the SMILES notation for 2-[1-[(1-methyl-2-oxopyridine-4-carbonyl)amino]cyclopentyl]acetic acid?
The canonical SMILES for 2-[1-[(1-methyl-2-oxopyridine-4-carbonyl)amino]cyclopentyl]acetic acid is Cn1ccc(C(=O)NC2(CC(=O)O)CCCC2)cc1=O.
What is the InChIKey of 2-[1-[(1-methyl-2-oxopyridine-4-carbonyl)amino]cyclopentyl]acetic acid?
The InChIKey is RYHQWYGYHNAATA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O4/c1-16-7-4-10(8-11(16)17)13(20)15-14(9-12(18)19)5-2-3-6-14/h4,7-8H,2-3,5-6,9H2,1H3,(H,15,20)(H,18,19).
What are the key properties of 2-[1-[(1-methyl-2-oxopyridine-4-carbonyl)amino]cyclopentyl]acetic acid?
2-[1-[(1-methyl-2-oxopyridine-4-carbonyl)amino]cyclopentyl]acetic acid has a molecular weight of 278.31 g/mol, XLogP of 0.90, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[(1-methyl-2-oxopyridine-4-carbonyl)amino]cyclopentyl]acetic acid is sourced from PubChem (CID 64673373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).