(2R)-2-amino-N-(4-chlorophenyl)pentanamide

C11H15ClN2O — CID 93255469

IUPAC(2R)-2-amino-N-(4-chlorophenyl)pentanamide
SMILESCCC[C@@H](N)C(=O)Nc1ccc(Cl)cc1
InChIInChI=1S/C11H15ClN2O/c1-2-3-10(13)11(15)14-9-6-4-8(12)5-7-9/h4-7,10H,2-3,13H2,1H3,(H,14,15)/t10-/m1/s1
InChIKeyGNDFUKAKCCMWHB-SNVBAGLBSA-N
MW226.71 g/mol
LogP2.41
Rot. Bonds4

About (2R)-2-amino-N-(4-chlorophenyl)pentanamide

(2R)-2-amino-N-(4-chlorophenyl)pentanamide (PubChem CID 93255469) has the molecular formula C11H15ClN2O and a molecular weight of 226.71 g/mol. Its IUPAC name is (2R)-2-amino-N-(4-chlorophenyl)pentanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-(4-chlorophenyl)pentanamide
PubChem CID93255469
Molecular FormulaC11H15ClN2O
Molecular Weight226.71 g/mol
Exact Mass226.09
IUPAC Name(2R)-2-amino-N-(4-chlorophenyl)pentanamide
SMILESCCC[C@@H](N)C(=O)Nc1ccc(Cl)cc1
InChIInChI=1S/C11H15ClN2O/c1-2-3-10(13)11(15)14-9-6-4-8(12)5-7-9/h4-7,10H,2-3,13H2,1H3,(H,14,15)/t10-/m1/s1
InChIKeyGNDFUKAKCCMWHB-SNVBAGLBSA-N
XLogP2.41
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.71
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-(4-chlorophenyl)pentanamide?
The IUPAC name of (2R)-2-amino-N-(4-chlorophenyl)pentanamide (CID 93255469) is (2R)-2-amino-N-(4-chlorophenyl)pentanamide.
What is the SMILES notation for (2R)-2-amino-N-(4-chlorophenyl)pentanamide?
The canonical SMILES for (2R)-2-amino-N-(4-chlorophenyl)pentanamide is CCC[C@@H](N)C(=O)Nc1ccc(Cl)cc1.
What is the InChIKey of (2R)-2-amino-N-(4-chlorophenyl)pentanamide?
The InChIKey is GNDFUKAKCCMWHB-SNVBAGLBSA-N. The full InChI is InChI=1S/C11H15ClN2O/c1-2-3-10(13)11(15)14-9-6-4-8(12)5-7-9/h4-7,10H,2-3,13H2,1H3,(H,14,15)/t10-/m1/s1.
What are the key properties of (2R)-2-amino-N-(4-chlorophenyl)pentanamide?
(2R)-2-amino-N-(4-chlorophenyl)pentanamide has a molecular weight of 226.71 g/mol, XLogP of 2.41, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-(4-chlorophenyl)pentanamide is sourced from PubChem (CID 93255469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).