2-[1-[(4,6-dimethyl-2-oxo-1H-pyridine-3-carbonyl)amino]cyclopentyl]acetic acid

C15H20N2O4 — CID 64672597

IUPAC2-[1-[(4,6-dimethyl-2-oxo-1H-pyridine-3-carbonyl)amino]cyclopentyl]acetic acid
SMILESCc1cc(C)c(C(=O)NC2(CC(=O)O)CCCC2)c(=O)[nH]1
InChIInChI=1S/C15H20N2O4/c1-9-7-10(2)16-13(20)12(9)14(21)17-15(8-11(18)19)5-3-4-6-15/h7H,3-6,8H2,1-2H3,(H,16,20)(H,17,21)(H,18,19)
InChIKeyLFOKENXIIXXMAL-UHFFFAOYSA-N
MW292.33 g/mol
LogP1.51
Rot. Bonds4

About 2-[1-[(4,6-dimethyl-2-oxo-1H-pyridine-3-carbonyl)amino]cyclopentyl]acetic acid

2-[1-[(4,6-dimethyl-2-oxo-1H-pyridine-3-carbonyl)amino]cyclopentyl]acetic acid (PubChem CID 64672597) has the molecular formula C15H20N2O4 and a molecular weight of 292.33 g/mol. Its IUPAC name is 2-[1-[(4,6-dimethyl-2-oxo-1H-pyridine-3-carbonyl)amino]cyclopentyl]acetic acid.

Molecular Properties

Compound Name2-[1-[(4,6-dimethyl-2-oxo-1H-pyridine-3-carbonyl)amino]cyclopentyl]acetic acid
PubChem CID64672597
Molecular FormulaC15H20N2O4
Molecular Weight292.33 g/mol
Exact Mass292.14
IUPAC Name2-[1-[(4,6-dimethyl-2-oxo-1H-pyridine-3-carbonyl)amino]cyclopentyl]acetic acid
SMILESCc1cc(C)c(C(=O)NC2(CC(=O)O)CCCC2)c(=O)[nH]1
InChIInChI=1S/C15H20N2O4/c1-9-7-10(2)16-13(20)12(9)14(21)17-15(8-11(18)19)5-3-4-6-15/h7H,3-6,8H2,1-2H3,(H,16,20)(H,17,21)(H,18,19)
InChIKeyLFOKENXIIXXMAL-UHFFFAOYSA-N
XLogP1.51
TPSA99.26 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.33
LogP ≤ 51.51
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[1-[(4,6-dimethyl-2-oxo-1H-pyridine-3-carbonyl)amino]cyclopentyl]acetic acid?
The IUPAC name of 2-[1-[(4,6-dimethyl-2-oxo-1H-pyridine-3-carbonyl)amino]cyclopentyl]acetic acid (CID 64672597) is 2-[1-[(4,6-dimethyl-2-oxo-1H-pyridine-3-carbonyl)amino]cyclopentyl]acetic acid.
What is the SMILES notation for 2-[1-[(4,6-dimethyl-2-oxo-1H-pyridine-3-carbonyl)amino]cyclopentyl]acetic acid?
The canonical SMILES for 2-[1-[(4,6-dimethyl-2-oxo-1H-pyridine-3-carbonyl)amino]cyclopentyl]acetic acid is Cc1cc(C)c(C(=O)NC2(CC(=O)O)CCCC2)c(=O)[nH]1.
What is the InChIKey of 2-[1-[(4,6-dimethyl-2-oxo-1H-pyridine-3-carbonyl)amino]cyclopentyl]acetic acid?
The InChIKey is LFOKENXIIXXMAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O4/c1-9-7-10(2)16-13(20)12(9)14(21)17-15(8-11(18)19)5-3-4-6-15/h7H,3-6,8H2,1-2H3,(H,16,20)(H,17,21)(H,18,19).
What are the key properties of 2-[1-[(4,6-dimethyl-2-oxo-1H-pyridine-3-carbonyl)amino]cyclopentyl]acetic acid?
2-[1-[(4,6-dimethyl-2-oxo-1H-pyridine-3-carbonyl)amino]cyclopentyl]acetic acid has a molecular weight of 292.33 g/mol, XLogP of 1.51, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[(4,6-dimethyl-2-oxo-1H-pyridine-3-carbonyl)amino]cyclopentyl]acetic acid is sourced from PubChem (CID 64672597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).