N-(2-methylcyclopentyl)-6-oxo-1H-pyridine-3-carboxamide

C12H16N2O2 — CID 63279324

IUPACN-(2-methylcyclopentyl)-6-oxo-1H-pyridine-3-carboxamide
SMILESCC1CCCC1NC(=O)c1ccc(=O)[nH]c1
InChIInChI=1S/C12H16N2O2/c1-8-3-2-4-10(8)14-12(16)9-5-6-11(15)13-7-9/h5-8,10H,2-4H2,1H3,(H,13,15)(H,14,16)
InChIKeyMVJJSJLUHYPVME-UHFFFAOYSA-N
MW220.27 g/mol
LogP1.29
Rot. Bonds2

About N-(2-methylcyclopentyl)-6-oxo-1H-pyridine-3-carboxamide

N-(2-methylcyclopentyl)-6-oxo-1H-pyridine-3-carboxamide (PubChem CID 63279324) has the molecular formula C12H16N2O2 and a molecular weight of 220.27 g/mol. Its IUPAC name is N-(2-methylcyclopentyl)-6-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-methylcyclopentyl)-6-oxo-1H-pyridine-3-carboxamide
PubChem CID63279324
Molecular FormulaC12H16N2O2
Molecular Weight220.27 g/mol
Exact Mass220.12
IUPAC NameN-(2-methylcyclopentyl)-6-oxo-1H-pyridine-3-carboxamide
SMILESCC1CCCC1NC(=O)c1ccc(=O)[nH]c1
InChIInChI=1S/C12H16N2O2/c1-8-3-2-4-10(8)14-12(16)9-5-6-11(15)13-7-9/h5-8,10H,2-4H2,1H3,(H,13,15)(H,14,16)
InChIKeyMVJJSJLUHYPVME-UHFFFAOYSA-N
XLogP1.29
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.27
LogP ≤ 51.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-methylcyclopentyl)-6-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-(2-methylcyclopentyl)-6-oxo-1H-pyridine-3-carboxamide (CID 63279324) is N-(2-methylcyclopentyl)-6-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-(2-methylcyclopentyl)-6-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-(2-methylcyclopentyl)-6-oxo-1H-pyridine-3-carboxamide is CC1CCCC1NC(=O)c1ccc(=O)[nH]c1.
What is the InChIKey of N-(2-methylcyclopentyl)-6-oxo-1H-pyridine-3-carboxamide?
The InChIKey is MVJJSJLUHYPVME-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O2/c1-8-3-2-4-10(8)14-12(16)9-5-6-11(15)13-7-9/h5-8,10H,2-4H2,1H3,(H,13,15)(H,14,16).
What are the key properties of N-(2-methylcyclopentyl)-6-oxo-1H-pyridine-3-carboxamide?
N-(2-methylcyclopentyl)-6-oxo-1H-pyridine-3-carboxamide has a molecular weight of 220.27 g/mol, XLogP of 1.29, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylcyclopentyl)-6-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 63279324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).