2-[(3,5-dimethylcyclohexyl)amino]-N-pentan-3-ylacetamide

C15H30N2O — CID 64734046

IUPAC2-[(3,5-dimethylcyclohexyl)amino]-N-pentan-3-ylacetamide
SMILESCCC(CC)NC(=O)CNC1CC(C)CC(C)C1
InChIInChI=1S/C15H30N2O/c1-5-13(6-2)17-15(18)10-16-14-8-11(3)7-12(4)9-14/h11-14,16H,5-10H2,1-4H3,(H,17,18)
InChIKeyZFDPUCSYPSRLGZ-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.71
Rot. Bonds6

About 2-[(3,5-dimethylcyclohexyl)amino]-N-pentan-3-ylacetamide

2-[(3,5-dimethylcyclohexyl)amino]-N-pentan-3-ylacetamide (PubChem CID 64734046) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is 2-[(3,5-dimethylcyclohexyl)amino]-N-pentan-3-ylacetamide.

Molecular Properties

Compound Name2-[(3,5-dimethylcyclohexyl)amino]-N-pentan-3-ylacetamide
PubChem CID64734046
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC Name2-[(3,5-dimethylcyclohexyl)amino]-N-pentan-3-ylacetamide
SMILESCCC(CC)NC(=O)CNC1CC(C)CC(C)C1
InChIInChI=1S/C15H30N2O/c1-5-13(6-2)17-15(18)10-16-14-8-11(3)7-12(4)9-14/h11-14,16H,5-10H2,1-4H3,(H,17,18)
InChIKeyZFDPUCSYPSRLGZ-UHFFFAOYSA-N
XLogP2.71
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-[(3,5-dimethylcyclohexyl)amino]-N-pentan-3-ylacetamide 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

2-(cyclobutylamino)-N-pentan-3-ylacetamide
CID 62413978
2-(cyclopropylamino)-N-[(2S)-1-hydroxybutan-2-yl]acetamide
CID 107222480
2-[(3-methylcyclopentyl)amino]-N-pentan-2-ylacetamide
CID 114545702
trans-(3S,5S)-3,5-dimethyl-N-pentan-3-ylcyclohexan-1-amine
CID 96732201
(2R)-2-[[(3R,5R)-3,5-dimethylcyclohexyl]amino]butan-1-ol
CID 124576040
2-[[(3S)-1-(cyclohepta-2,4,6-triene-1-carbonyl)pyrrolidin-3-yl]amino]-N-pentan-3-ylacetamide
CID 154853193
N-ethyl-3,5-dimethylcyclohexan-1-amine
CID 64722982
2-(cyclopropylamino)-N-(2-methylpentan-3-yl)acetamide
CID 61470431
N-butan-2-yl-2-[(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)amino]acetamide
CID 65471067
2-(1,3-dihydroxypropan-2-ylamino)-N-pentan-3-ylacetamide
CID 65313831
N-cyclohexyl-2-[(3-methylcyclohexyl)amino]acetamide
CID 43317870
2-[(5-methylthiolan-3-yl)amino]-N-propan-2-ylacetamide
CID 79941340

Frequently Asked Questions

What is the IUPAC name of 2-[(3,5-dimethylcyclohexyl)amino]-N-pentan-3-ylacetamide?
The IUPAC name of 2-[(3,5-dimethylcyclohexyl)amino]-N-pentan-3-ylacetamide (CID 64734046) is 2-[(3,5-dimethylcyclohexyl)amino]-N-pentan-3-ylacetamide.
What is the SMILES notation for 2-[(3,5-dimethylcyclohexyl)amino]-N-pentan-3-ylacetamide?
The canonical SMILES for 2-[(3,5-dimethylcyclohexyl)amino]-N-pentan-3-ylacetamide is CCC(CC)NC(=O)CNC1CC(C)CC(C)C1.
What is the InChIKey of 2-[(3,5-dimethylcyclohexyl)amino]-N-pentan-3-ylacetamide?
The InChIKey is ZFDPUCSYPSRLGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-5-13(6-2)17-15(18)10-16-14-8-11(3)7-12(4)9-14/h11-14,16H,5-10H2,1-4H3,(H,17,18).
What are the key properties of 2-[(3,5-dimethylcyclohexyl)amino]-N-pentan-3-ylacetamide?
2-[(3,5-dimethylcyclohexyl)amino]-N-pentan-3-ylacetamide has a molecular weight of 254.42 g/mol, XLogP of 2.71, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3,5-dimethylcyclohexyl)amino]-N-pentan-3-ylacetamide is sourced from PubChem (CID 64734046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).