(2R)-2-(cyclopropylcarbamoylamino)pentanoic acid

C9H16N2O3 — CID 107564781

IUPAC(2R)-2-(cyclopropylcarbamoylamino)pentanoic acid
SMILESCCC[C@@H](NC(=O)NC1CC1)C(=O)O
InChIInChI=1S/C9H16N2O3/c1-2-3-7(8(12)13)11-9(14)10-6-4-5-6/h6-7H,2-5H2,1H3,(H,12,13)(H2,10,11,14)/t7-/m1/s1
InChIKeyDEDGNSPYZICGDN-SSDOTTSWSA-N
MW200.24 g/mol
LogP0.70
Rot. Bonds5

About (2R)-2-(cyclopropylcarbamoylamino)pentanoic acid

(2R)-2-(cyclopropylcarbamoylamino)pentanoic acid (PubChem CID 107564781) has the molecular formula C9H16N2O3 and a molecular weight of 200.24 g/mol. Its IUPAC name is (2R)-2-(cyclopropylcarbamoylamino)pentanoic acid.

Molecular Properties

Compound Name(2R)-2-(cyclopropylcarbamoylamino)pentanoic acid
PubChem CID107564781
Molecular FormulaC9H16N2O3
Molecular Weight200.24 g/mol
Exact Mass200.12
IUPAC Name(2R)-2-(cyclopropylcarbamoylamino)pentanoic acid
SMILESCCC[C@@H](NC(=O)NC1CC1)C(=O)O
InChIInChI=1S/C9H16N2O3/c1-2-3-7(8(12)13)11-9(14)10-6-4-5-6/h6-7H,2-5H2,1H3,(H,12,13)(H2,10,11,14)/t7-/m1/s1
InChIKeyDEDGNSPYZICGDN-SSDOTTSWSA-N
XLogP0.70
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.24
LogP ≤ 50.70
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Analyze (2R)-2-(cyclopropylcarbamoylamino)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

(2S)-2-[(4-ethylcyclohexyl)carbamoylamino]pentanoic acid
CID 107566467
(2R)-2-(cyclooctylcarbamoylamino)pentanoic acid
CID 107565953
2-[(3,5-dimethylcyclohexyl)carbamoylamino]pentanoic acid
CID 64732149
2-(cyclopropylcarbamoylamino)-4-methylsulfonylbutanoic acid
CID 61188645
(2R)-2-[(1-methylpyrrolidin-3-yl)carbamoylamino]pentanoic acid
CID 107566455
(2S)-2-[(1-cyclopropylpyrrolidin-3-yl)carbamoylamino]pentanoic acid
CID 107566680
(2S)-2-[(1,2-dimethylpiperidin-4-yl)carbamoylamino]pentanoic acid
CID 107567367
(2R)-2-[(2-methylcyclopentyl)carbamoylamino]pentanoic acid
CID 107566972
(2R)-2-[(5-oxopyrrolidin-3-yl)carbamoylamino]pentanoic acid
CID 106192089
2-[(4-ethylcyclohexyl)carbamoylamino]-4-methylsulfanylbutanoic acid
CID 61468068
2-[(2,2,3,3-tetramethylcyclopropyl)carbamoylamino]pentanoic acid
CID 79350424
2-(cyclohexylcarbamoylamino)butanoic acid
CID 43469984

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(cyclopropylcarbamoylamino)pentanoic acid?
The IUPAC name of (2R)-2-(cyclopropylcarbamoylamino)pentanoic acid (CID 107564781) is (2R)-2-(cyclopropylcarbamoylamino)pentanoic acid.
What is the SMILES notation for (2R)-2-(cyclopropylcarbamoylamino)pentanoic acid?
The canonical SMILES for (2R)-2-(cyclopropylcarbamoylamino)pentanoic acid is CCC[C@@H](NC(=O)NC1CC1)C(=O)O.
What is the InChIKey of (2R)-2-(cyclopropylcarbamoylamino)pentanoic acid?
The InChIKey is DEDGNSPYZICGDN-SSDOTTSWSA-N. The full InChI is InChI=1S/C9H16N2O3/c1-2-3-7(8(12)13)11-9(14)10-6-4-5-6/h6-7H,2-5H2,1H3,(H,12,13)(H2,10,11,14)/t7-/m1/s1.
What are the key properties of (2R)-2-(cyclopropylcarbamoylamino)pentanoic acid?
(2R)-2-(cyclopropylcarbamoylamino)pentanoic acid has a molecular weight of 200.24 g/mol, XLogP of 0.70, 5 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(cyclopropylcarbamoylamino)pentanoic acid is sourced from PubChem (CID 107564781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).