(2S)-2-amino-N-(1-phenylpentan-2-yl)propanamide

C14H22N2O — CID 119317190

IUPAC(2S)-2-amino-N-(1-phenylpentan-2-yl)propanamide
SMILESCCCC(Cc1ccccc1)NC(=O)[C@H](C)N
InChIInChI=1S/C14H22N2O/c1-3-7-13(16-14(17)11(2)15)10-12-8-5-4-6-9-12/h4-6,8-9,11,13H,3,7,10,15H2,1-2H3,(H,16,17)/t11-,13?/m0/s1
InChIKeyKWNRZRMTBYKAJK-AMGKYWFPSA-N
MW234.34 g/mol
LogP1.86
Rot. Bonds6

About (2S)-2-amino-N-(1-phenylpentan-2-yl)propanamide

(2S)-2-amino-N-(1-phenylpentan-2-yl)propanamide (PubChem CID 119317190) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is (2S)-2-amino-N-(1-phenylpentan-2-yl)propanamide.

Molecular Properties

Compound Name(2S)-2-amino-N-(1-phenylpentan-2-yl)propanamide
PubChem CID119317190
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name(2S)-2-amino-N-(1-phenylpentan-2-yl)propanamide
SMILESCCCC(Cc1ccccc1)NC(=O)[C@H](C)N
InChIInChI=1S/C14H22N2O/c1-3-7-13(16-14(17)11(2)15)10-12-8-5-4-6-9-12/h4-6,8-9,11,13H,3,7,10,15H2,1-2H3,(H,16,17)/t11-,13?/m0/s1
InChIKeyKWNRZRMTBYKAJK-AMGKYWFPSA-N
XLogP1.86
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze (2S)-2-amino-N-(1-phenylpentan-2-yl)propanamide 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-amino-3-methyl-N-(1-phenylpentan-2-yl)pentanamide;hydrochloride
CID 119772630
(2R)-2-amino-N-(1-phenylpropan-2-yl)propanamide
CID 78923419
ethyl (2S)-2-[[(2S)-2-aminopropanoyl]amino]-3-phenylpropanoate
CID 15546721
(2S)-2-amino-N-[(2S)-1-[[(2S)-1-chloro-3-phenylpropan-2-yl]amino]-1-oxopropan-2-yl]propanamide
CID 101012552
2-(2-aminopropanoylamino)-3-phenylpropanoic acid
CID 2080
2-[[(2S)-2-aminopropanoyl]amino]-3-phenylpropanoic acid
CID 68969553
(2R)-2-amino-N-(4-phenylbutan-2-yl)propanamide
CID 14620809
2-amino-2-(oxan-4-yl)-N-(1-phenylpentan-2-yl)acetamide;hydrochloride
CID 120791991
2-(1-phenylpentan-2-ylamino)propanoic acid
CID 122035581
2-[[(2R)-2-aminopropanoyl]amino]-3-phenylpropanamide
CID 119306654
2-methyl-3-[methyl(1-phenylpentan-2-ylcarbamoyl)amino]propanoic acid
CID 122000555
(2S)-2-[(2-amino-3-phenylpropanoyl)amino]pentanoic acid
CID 103869775

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-N-(1-phenylpentan-2-yl)propanamide?
The IUPAC name of (2S)-2-amino-N-(1-phenylpentan-2-yl)propanamide (CID 119317190) is (2S)-2-amino-N-(1-phenylpentan-2-yl)propanamide.
What is the SMILES notation for (2S)-2-amino-N-(1-phenylpentan-2-yl)propanamide?
The canonical SMILES for (2S)-2-amino-N-(1-phenylpentan-2-yl)propanamide is CCCC(Cc1ccccc1)NC(=O)[C@H](C)N.
What is the InChIKey of (2S)-2-amino-N-(1-phenylpentan-2-yl)propanamide?
The InChIKey is KWNRZRMTBYKAJK-AMGKYWFPSA-N. The full InChI is InChI=1S/C14H22N2O/c1-3-7-13(16-14(17)11(2)15)10-12-8-5-4-6-9-12/h4-6,8-9,11,13H,3,7,10,15H2,1-2H3,(H,16,17)/t11-,13?/m0/s1.
What are the key properties of (2S)-2-amino-N-(1-phenylpentan-2-yl)propanamide?
(2S)-2-amino-N-(1-phenylpentan-2-yl)propanamide has a molecular weight of 234.34 g/mol, XLogP of 1.86, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-N-(1-phenylpentan-2-yl)propanamide is sourced from PubChem (CID 119317190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).