N-(3-methylcyclopentyl)-3-(oxolan-2-yl)propanamide

C13H23NO2 — CID 114549731

IUPACN-(3-methylcyclopentyl)-3-(oxolan-2-yl)propanamide
SMILESCC1CCC(NC(=O)CCC2CCCO2)C1
InChIInChI=1S/C13H23NO2/c1-10-4-5-11(9-10)14-13(15)7-6-12-3-2-8-16-12/h10-12H,2-9H2,1H3,(H,14,15)
InChIKeyATUOZZQNEJBJDY-UHFFFAOYSA-N
MW225.33 g/mol
LogP2.25
Rot. Bonds4

About N-(3-methylcyclopentyl)-3-(oxolan-2-yl)propanamide

N-(3-methylcyclopentyl)-3-(oxolan-2-yl)propanamide (PubChem CID 114549731) has the molecular formula C13H23NO2 and a molecular weight of 225.33 g/mol. Its IUPAC name is N-(3-methylcyclopentyl)-3-(oxolan-2-yl)propanamide.

Molecular Properties

Compound NameN-(3-methylcyclopentyl)-3-(oxolan-2-yl)propanamide
PubChem CID114549731
Molecular FormulaC13H23NO2
Molecular Weight225.33 g/mol
Exact Mass225.17
IUPAC NameN-(3-methylcyclopentyl)-3-(oxolan-2-yl)propanamide
SMILESCC1CCC(NC(=O)CCC2CCCO2)C1
InChIInChI=1S/C13H23NO2/c1-10-4-5-11(9-10)14-13(15)7-6-12-3-2-8-16-12/h10-12H,2-9H2,1H3,(H,14,15)
InChIKeyATUOZZQNEJBJDY-UHFFFAOYSA-N
XLogP2.25
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.33
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-methylcyclohexyl)-3-[(2R)-oxolan-2-yl]propanamide
CID 51728648
cis-(1R,3S)-3-[3-(oxan-2-yl)propanoylamino]cyclopentane-1-carboxylic acid
CID 106320914
3-[3-(oxan-2-yl)propanoylamino]cyclopentane-1-carboxylic acid
CID 66030722
N-(2-methylpiperidin-4-yl)-3-(oxan-2-yl)propanamide
CID 106995469
N-(4-oxocyclohexyl)-3-(oxolan-2-yl)propanamide
CID 65155572
N-(1-methylsulfonylpiperidin-4-yl)-3-[(2S)-oxolan-2-yl]propanamide
CID 94097831
3-(oxan-2-yl)-N-piperidin-4-ylpropanamide;hydrochloride
CID 119386884
N-(3-methylcyclopentyl)-3-(propan-2-ylamino)propanamide
CID 114546265
2-cyclopropylidene-N-[(1R,2R,4R)-2-hydroxy-4-[3-(oxolan-2-yl)propanoylamino]cyclopentyl]propanamide
CID 167992949
N-(2-bromocyclopentyl)-3-(oxolan-2-yl)propanamide
CID 80661636
4-[3-(oxolan-2-yl)propanoylamino]oxolane-3-carboxylic acid
CID 66222668
N-(3-methylpiperidin-4-yl)-3-(oxolan-2-yl)propanamide;hydrochloride
CID 120557577

Frequently Asked Questions

What is the IUPAC name of N-(3-methylcyclopentyl)-3-(oxolan-2-yl)propanamide?
The IUPAC name of N-(3-methylcyclopentyl)-3-(oxolan-2-yl)propanamide (CID 114549731) is N-(3-methylcyclopentyl)-3-(oxolan-2-yl)propanamide.
What is the SMILES notation for N-(3-methylcyclopentyl)-3-(oxolan-2-yl)propanamide?
The canonical SMILES for N-(3-methylcyclopentyl)-3-(oxolan-2-yl)propanamide is CC1CCC(NC(=O)CCC2CCCO2)C1.
What is the InChIKey of N-(3-methylcyclopentyl)-3-(oxolan-2-yl)propanamide?
The InChIKey is ATUOZZQNEJBJDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NO2/c1-10-4-5-11(9-10)14-13(15)7-6-12-3-2-8-16-12/h10-12H,2-9H2,1H3,(H,14,15).
What are the key properties of N-(3-methylcyclopentyl)-3-(oxolan-2-yl)propanamide?
N-(3-methylcyclopentyl)-3-(oxolan-2-yl)propanamide has a molecular weight of 225.33 g/mol, XLogP of 2.25, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylcyclopentyl)-3-(oxolan-2-yl)propanamide is sourced from PubChem (CID 114549731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).