2-acetamido-3-(cyclopentylmethoxy)-N-methylbutanamide

C13H24N2O3 — CID 164605032

IUPAC2-acetamido-3-(cyclopentylmethoxy)-N-methylbutanamide
SMILESCNC(=O)C(NC(C)=O)C(C)OCC1CCCC1
InChIInChI=1S/C13H24N2O3/c1-9(18-8-11-6-4-5-7-11)12(13(17)14-3)15-10(2)16/h9,11-12H,4-8H2,1-3H3,(H,14,17)(H,15,16)
InChIKeyNLHKQAABYFTYOW-UHFFFAOYSA-N
MW256.35 g/mol
LogP0.83
Rot. Bonds6

About 2-acetamido-3-(cyclopentylmethoxy)-N-methylbutanamide

2-acetamido-3-(cyclopentylmethoxy)-N-methylbutanamide (PubChem CID 164605032) has the molecular formula C13H24N2O3 and a molecular weight of 256.35 g/mol. Its IUPAC name is 2-acetamido-3-(cyclopentylmethoxy)-N-methylbutanamide.

Molecular Properties

Compound Name2-acetamido-3-(cyclopentylmethoxy)-N-methylbutanamide
PubChem CID164605032
Molecular FormulaC13H24N2O3
Molecular Weight256.35 g/mol
Exact Mass256.18
IUPAC Name2-acetamido-3-(cyclopentylmethoxy)-N-methylbutanamide
SMILESCNC(=O)C(NC(C)=O)C(C)OCC1CCCC1
InChIInChI=1S/C13H24N2O3/c1-9(18-8-11-6-4-5-7-11)12(13(17)14-3)15-10(2)16/h9,11-12H,4-8H2,1-3H3,(H,14,17)(H,15,16)
InChIKeyNLHKQAABYFTYOW-UHFFFAOYSA-N
XLogP0.83
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 50.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-acetamido-3-(cyclopentylmethoxy)-N-methylbutanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(cyclopentylmethoxy)-N-methyl-2-(2-methylpropanoylamino)butanamide
CID 171594077
2-acetamido-3-[(4,4-dimethylcyclohexyl)methoxy]-N-methylbutanamide
CID 174329363
3-(cycloheptylmethoxy)-N-methyl-2-(2-methylpropanoylamino)butanamide
CID 171593836
2-acetamido-N-methyl-3-(oxan-4-ylmethoxy)butanamide;ethane
CID 164604737
2-acetamido-3-(2-cyclohexylethoxy)-N-methylbutanamide
CID 164604698
N-[3-(cyclohexylmethoxy)-1-(2-formylpiperidin-1-yl)-1-oxobutan-2-yl]acetamide
CID 170758965
N-[1,3-bis(cyclohexylmethoxy)butan-2-yl]acetamide
CID 164604144
N-[1-[2-(aminomethyl)pyrrolidin-1-yl]-3-(cyclohexylmethoxy)-1-oxobutan-2-yl]acetamide
CID 170755642
2-acetamido-3-[acetyl(cyclohexylmethyl)amino]-N-methylbutanamide
CID 174328879
2-(cyclopentylmethoxy)-N,3,3-trimethylbutanamide
CID 70921332
2-(cyclopentylmethoxy)propanehydrazide
CID 66321450
2-acetamido-2-[1-(cyclohexylmethoxy)cyclopropyl]-N-methylacetamide
CID 164604521

Frequently Asked Questions

What is the IUPAC name of 2-acetamido-3-(cyclopentylmethoxy)-N-methylbutanamide?
The IUPAC name of 2-acetamido-3-(cyclopentylmethoxy)-N-methylbutanamide (CID 164605032) is 2-acetamido-3-(cyclopentylmethoxy)-N-methylbutanamide.
What is the SMILES notation for 2-acetamido-3-(cyclopentylmethoxy)-N-methylbutanamide?
The canonical SMILES for 2-acetamido-3-(cyclopentylmethoxy)-N-methylbutanamide is CNC(=O)C(NC(C)=O)C(C)OCC1CCCC1.
What is the InChIKey of 2-acetamido-3-(cyclopentylmethoxy)-N-methylbutanamide?
The InChIKey is NLHKQAABYFTYOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O3/c1-9(18-8-11-6-4-5-7-11)12(13(17)14-3)15-10(2)16/h9,11-12H,4-8H2,1-3H3,(H,14,17)(H,15,16).
What are the key properties of 2-acetamido-3-(cyclopentylmethoxy)-N-methylbutanamide?
2-acetamido-3-(cyclopentylmethoxy)-N-methylbutanamide has a molecular weight of 256.35 g/mol, XLogP of 0.83, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-acetamido-3-(cyclopentylmethoxy)-N-methylbutanamide is sourced from PubChem (CID 164605032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).