2-(2-cyclopropylpropanoylamino)pentanoic acid

C11H19NO3 — CID 83147334

IUPAC2-(2-cyclopropylpropanoylamino)pentanoic acid
SMILESCCCC(NC(=O)C(C)C1CC1)C(=O)O
InChIInChI=1S/C11H19NO3/c1-3-4-9(11(14)15)12-10(13)7(2)8-5-6-8/h7-9H,3-6H2,1-2H3,(H,12,13)(H,14,15)
InChIKeySOJZMONHCJSWGO-UHFFFAOYSA-N
MW213.28 g/mol
LogP1.40
Rot. Bonds6

About 2-(2-cyclopropylpropanoylamino)pentanoic acid

2-(2-cyclopropylpropanoylamino)pentanoic acid (PubChem CID 83147334) has the molecular formula C11H19NO3 and a molecular weight of 213.28 g/mol. Its IUPAC name is 2-(2-cyclopropylpropanoylamino)pentanoic acid.

Molecular Properties

Compound Name2-(2-cyclopropylpropanoylamino)pentanoic acid
PubChem CID83147334
Molecular FormulaC11H19NO3
Molecular Weight213.28 g/mol
Exact Mass213.14
IUPAC Name2-(2-cyclopropylpropanoylamino)pentanoic acid
SMILESCCCC(NC(=O)C(C)C1CC1)C(=O)O
InChIInChI=1S/C11H19NO3/c1-3-4-9(11(14)15)12-10(13)7(2)8-5-6-8/h7-9H,3-6H2,1-2H3,(H,12,13)(H,14,15)
InChIKeySOJZMONHCJSWGO-UHFFFAOYSA-N
XLogP1.40
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 51.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-(2-cyclopropylpropanoylamino)pentanoic acid 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-[(2,2-dicyclopropylacetyl)amino]pentanoic acid
CID 120534692
2-(1-cyclopropylethylcarbamoylamino)pentanoic acid
CID 61198675
(2S)-2-(2-cyclopropylpropanoylamino)-4-methoxy-4-oxobutanoic acid
CID 83146560
2-cyclopropyl-2-(2-methylpentanoylamino)acetic acid
CID 62695331
2-[[3-(ethylamino)-2-methylpropanoyl]amino]pentanoic acid
CID 62837131
(2R)-2-(2,3-dimethylbutanoylamino)pentanoic acid
CID 107563339
2-(2-cyclopropylpropanoylamino)propanoic acid
CID 81456146
N-[(1S)-1-cyclopropylethyl]-2-methylpentanamide
CID 161003325
4-hydroxy-2-(2-methylpentanoylamino)butanoic acid
CID 61243280
(2R)-2-[2-(methylamino)propanoylamino]pentanoic acid
CID 107564986
2-(2-ethylbutanoylamino)pentanoic acid
CID 43630315
(2S)-2-[(4-amino-2-methylbutanoyl)amino]pentanoic acid
CID 107565180

Frequently Asked Questions

What is the IUPAC name of 2-(2-cyclopropylpropanoylamino)pentanoic acid?
The IUPAC name of 2-(2-cyclopropylpropanoylamino)pentanoic acid (CID 83147334) is 2-(2-cyclopropylpropanoylamino)pentanoic acid.
What is the SMILES notation for 2-(2-cyclopropylpropanoylamino)pentanoic acid?
The canonical SMILES for 2-(2-cyclopropylpropanoylamino)pentanoic acid is CCCC(NC(=O)C(C)C1CC1)C(=O)O.
What is the InChIKey of 2-(2-cyclopropylpropanoylamino)pentanoic acid?
The InChIKey is SOJZMONHCJSWGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO3/c1-3-4-9(11(14)15)12-10(13)7(2)8-5-6-8/h7-9H,3-6H2,1-2H3,(H,12,13)(H,14,15).
What are the key properties of 2-(2-cyclopropylpropanoylamino)pentanoic acid?
2-(2-cyclopropylpropanoylamino)pentanoic acid has a molecular weight of 213.28 g/mol, XLogP of 1.40, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyclopropylpropanoylamino)pentanoic acid is sourced from PubChem (CID 83147334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).