(2S)-2-amino-1-cyclopentyl-3-methylbutan-1-one

C10H19NO — CID 174421994

IUPAC(2S)-2-amino-1-cyclopentyl-3-methylbutan-1-one
SMILESCC(C)[C@H](N)C(=O)C1CCCC1
InChIInChI=1S/C10H19NO/c1-7(2)9(11)10(12)8-5-3-4-6-8/h7-9H,3-6,11H2,1-2H3/t9-/m0/s1
InChIKeyGBBZKCZIEXAEDT-VIFPVBQESA-N
MW169.27 g/mol
LogP1.73
Rot. Bonds3

About (2S)-2-amino-1-cyclopentyl-3-methylbutan-1-one

(2S)-2-amino-1-cyclopentyl-3-methylbutan-1-one (PubChem CID 174421994) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is (2S)-2-amino-1-cyclopentyl-3-methylbutan-1-one.

Molecular Properties

Compound Name(2S)-2-amino-1-cyclopentyl-3-methylbutan-1-one
PubChem CID174421994
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name(2S)-2-amino-1-cyclopentyl-3-methylbutan-1-one
SMILESCC(C)[C@H](N)C(=O)C1CCCC1
InChIInChI=1S/C10H19NO/c1-7(2)9(11)10(12)8-5-3-4-6-8/h7-9H,3-6,11H2,1-2H3/t9-/m0/s1
InChIKeyGBBZKCZIEXAEDT-VIFPVBQESA-N
XLogP1.73
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (2S)-2-amino-1-cyclopentyl-3-methylbutan-1-one 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

(2S)-2-amino-1-cyclopropyl-3-methylbutan-1-one
CID 59677798
2-amino-1-cyclohexyl-3-methylpentan-1-one
CID 59078548
3-amino-1-cyclopentyl-2-methylbutan-1-one
CID 116612102
2-amino-3-methyl-1-(oxolan-3-yl)butan-1-one
CID 116548922
[(1R)-2-(2-amino-3-methylbutanoyl)cyclopentyl]boronic acid
CID 174247322
1,3-di(cyclobutyl)-2-methylpropane-1,3-dione
CID 165484396
1-cyclopentyl-2-(hydroxymethyl)-3-methylbutan-1-one
CID 116923369
1-cyclohexyl-2,3-dimethylbutan-1-one;ethane;ethene
CID 143362777
1-cyclopentyl-2-ethyl-3-methylbutan-1-one
CID 134474647
methyl 3-cyclopentyl-2-fluoro-3-oxopropanoate
CID 105443001
1-aminoethanol;cyclohexanecarboxylic acid
CID 173051544
(3R)-3-amino-1-cyclohexyl-4-methylpentan-2-one
CID 58418389

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-1-cyclopentyl-3-methylbutan-1-one?
The IUPAC name of (2S)-2-amino-1-cyclopentyl-3-methylbutan-1-one (CID 174421994) is (2S)-2-amino-1-cyclopentyl-3-methylbutan-1-one.
What is the SMILES notation for (2S)-2-amino-1-cyclopentyl-3-methylbutan-1-one?
The canonical SMILES for (2S)-2-amino-1-cyclopentyl-3-methylbutan-1-one is CC(C)[C@H](N)C(=O)C1CCCC1.
What is the InChIKey of (2S)-2-amino-1-cyclopentyl-3-methylbutan-1-one?
The InChIKey is GBBZKCZIEXAEDT-VIFPVBQESA-N. The full InChI is InChI=1S/C10H19NO/c1-7(2)9(11)10(12)8-5-3-4-6-8/h7-9H,3-6,11H2,1-2H3/t9-/m0/s1.
What are the key properties of (2S)-2-amino-1-cyclopentyl-3-methylbutan-1-one?
(2S)-2-amino-1-cyclopentyl-3-methylbutan-1-one has a molecular weight of 169.27 g/mol, XLogP of 1.73, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-1-cyclopentyl-3-methylbutan-1-one is sourced from PubChem (CID 174421994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).