N-(1-methylcyclopentyl)-2-oxopropanamide

C9H15NO2 — CID 130676811

IUPACN-(1-methylcyclopentyl)-2-oxopropanamide
SMILESCC(=O)C(=O)NC1(C)CCCC1
InChIInChI=1S/C9H15NO2/c1-7(11)8(12)10-9(2)5-3-4-6-9/h3-6H2,1-2H3,(H,10,12)
InChIKeyUKYPJVGPVDSODB-UHFFFAOYSA-N
MW169.22 g/mol
LogP1.02
Rot. Bonds2

About N-(1-methylcyclopentyl)-2-oxopropanamide

N-(1-methylcyclopentyl)-2-oxopropanamide (PubChem CID 130676811) has the molecular formula C9H15NO2 and a molecular weight of 169.22 g/mol. Its IUPAC name is N-(1-methylcyclopentyl)-2-oxopropanamide.

Molecular Properties

Compound NameN-(1-methylcyclopentyl)-2-oxopropanamide
PubChem CID130676811
Molecular FormulaC9H15NO2
Molecular Weight169.22 g/mol
Exact Mass169.11
IUPAC NameN-(1-methylcyclopentyl)-2-oxopropanamide
SMILESCC(=O)C(=O)NC1(C)CCCC1
InChIInChI=1S/C9H15NO2/c1-7(11)8(12)10-9(2)5-3-4-6-9/h3-6H2,1-2H3,(H,10,12)
InChIKeyUKYPJVGPVDSODB-UHFFFAOYSA-N
XLogP1.02
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.22
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(1-methylcyclopentyl)-2-oxopropanamide?
The IUPAC name of N-(1-methylcyclopentyl)-2-oxopropanamide (CID 130676811) is N-(1-methylcyclopentyl)-2-oxopropanamide.
What is the SMILES notation for N-(1-methylcyclopentyl)-2-oxopropanamide?
The canonical SMILES for N-(1-methylcyclopentyl)-2-oxopropanamide is CC(=O)C(=O)NC1(C)CCCC1.
What is the InChIKey of N-(1-methylcyclopentyl)-2-oxopropanamide?
The InChIKey is UKYPJVGPVDSODB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO2/c1-7(11)8(12)10-9(2)5-3-4-6-9/h3-6H2,1-2H3,(H,10,12).
What are the key properties of N-(1-methylcyclopentyl)-2-oxopropanamide?
N-(1-methylcyclopentyl)-2-oxopropanamide has a molecular weight of 169.22 g/mol, XLogP of 1.02, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methylcyclopentyl)-2-oxopropanamide is sourced from PubChem (CID 130676811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).