(2R)-2-amino-2-cyclohexylpropanoic acid

C9H17NO2 — CID 11240741

IUPAC(2R)-2-amino-2-cyclohexylpropanoic acid
SMILESC[C@](N)(C(=O)O)C1CCCCC1
InChIInChI=1S/C9H17NO2/c1-9(10,8(11)12)7-5-3-2-4-6-7/h7H,2-6,10H2,1H3,(H,11,12)/t9-/m1/s1
InChIKeyYXQOVXILWFIANY-SECBINFHSA-N
MW171.24 g/mol
LogP1.37
Rot. Bonds2

About (2R)-2-amino-2-cyclohexylpropanoic acid

(2R)-2-amino-2-cyclohexylpropanoic acid (PubChem CID 11240741) has the molecular formula C9H17NO2 and a molecular weight of 171.24 g/mol. Its IUPAC name is (2R)-2-amino-2-cyclohexylpropanoic acid.

Molecular Properties

Compound Name(2R)-2-amino-2-cyclohexylpropanoic acid
PubChem CID11240741
Molecular FormulaC9H17NO2
Molecular Weight171.24 g/mol
Exact Mass171.13
IUPAC Name(2R)-2-amino-2-cyclohexylpropanoic acid
SMILESC[C@](N)(C(=O)O)C1CCCCC1
InChIInChI=1S/C9H17NO2/c1-9(10,8(11)12)7-5-3-2-4-6-7/h7H,2-6,10H2,1H3,(H,11,12)/t9-/m1/s1
InChIKeyYXQOVXILWFIANY-SECBINFHSA-N
XLogP1.37
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.24
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze (2R)-2-amino-2-cyclohexylpropanoic 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 (2R)-2-amino-2-cyclohexylpropanoic acid?
The IUPAC name of (2R)-2-amino-2-cyclohexylpropanoic acid (CID 11240741) is (2R)-2-amino-2-cyclohexylpropanoic acid.
What is the SMILES notation for (2R)-2-amino-2-cyclohexylpropanoic acid?
The canonical SMILES for (2R)-2-amino-2-cyclohexylpropanoic acid is C[C@](N)(C(=O)O)C1CCCCC1.
What is the InChIKey of (2R)-2-amino-2-cyclohexylpropanoic acid?
The InChIKey is YXQOVXILWFIANY-SECBINFHSA-N. The full InChI is InChI=1S/C9H17NO2/c1-9(10,8(11)12)7-5-3-2-4-6-7/h7H,2-6,10H2,1H3,(H,11,12)/t9-/m1/s1.
What are the key properties of (2R)-2-amino-2-cyclohexylpropanoic acid?
(2R)-2-amino-2-cyclohexylpropanoic acid has a molecular weight of 171.24 g/mol, XLogP of 1.37, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-2-cyclohexylpropanoic acid is sourced from PubChem (CID 11240741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).