2-[cyclopentyl(methyl)amino]-2-methylbutanoic acid

C11H21NO2 — CID 82238511

IUPAC2-[cyclopentyl(methyl)amino]-2-methylbutanoic acid
SMILESCCC(C)(C(=O)O)N(C)C1CCCC1
InChIInChI=1S/C11H21NO2/c1-4-11(2,10(13)14)12(3)9-7-5-6-8-9/h9H,4-8H2,1-3H3,(H,13,14)
InChIKeyRSLRUPGKGGVBKH-UHFFFAOYSA-N
MW199.29 g/mol
LogP2.11
Rot. Bonds4

About 2-[cyclopentyl(methyl)amino]-2-methylbutanoic acid

2-[cyclopentyl(methyl)amino]-2-methylbutanoic acid (PubChem CID 82238511) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is 2-[cyclopentyl(methyl)amino]-2-methylbutanoic acid.

Molecular Properties

Compound Name2-[cyclopentyl(methyl)amino]-2-methylbutanoic acid
PubChem CID82238511
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC Name2-[cyclopentyl(methyl)amino]-2-methylbutanoic acid
SMILESCCC(C)(C(=O)O)N(C)C1CCCC1
InChIInChI=1S/C11H21NO2/c1-4-11(2,10(13)14)12(3)9-7-5-6-8-9/h9H,4-8H2,1-3H3,(H,13,14)
InChIKeyRSLRUPGKGGVBKH-UHFFFAOYSA-N
XLogP2.11
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-[cyclopentyl(methyl)amino]-2-methylbutanoic acid with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[cyclopentyl(methyl)amino]-2-methylbutanoic acid?
The IUPAC name of 2-[cyclopentyl(methyl)amino]-2-methylbutanoic acid (CID 82238511) is 2-[cyclopentyl(methyl)amino]-2-methylbutanoic acid.
What is the SMILES notation for 2-[cyclopentyl(methyl)amino]-2-methylbutanoic acid?
The canonical SMILES for 2-[cyclopentyl(methyl)amino]-2-methylbutanoic acid is CCC(C)(C(=O)O)N(C)C1CCCC1.
What is the InChIKey of 2-[cyclopentyl(methyl)amino]-2-methylbutanoic acid?
The InChIKey is RSLRUPGKGGVBKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO2/c1-4-11(2,10(13)14)12(3)9-7-5-6-8-9/h9H,4-8H2,1-3H3,(H,13,14).
What are the key properties of 2-[cyclopentyl(methyl)amino]-2-methylbutanoic acid?
2-[cyclopentyl(methyl)amino]-2-methylbutanoic acid has a molecular weight of 199.29 g/mol, XLogP of 2.11, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopentyl(methyl)amino]-2-methylbutanoic acid is sourced from PubChem (CID 82238511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).