(2R)-2-amino-N-pent-4-en-2-yl-3-phenylpropanamide

C14H20N2O — CID 103797386

IUPAC(2R)-2-amino-N-pent-4-en-2-yl-3-phenylpropanamide
SMILESC=CCC(C)NC(=O)[C@H](N)Cc1ccccc1
InChIInChI=1S/C14H20N2O/c1-3-7-11(2)16-14(17)13(15)10-12-8-5-4-6-9-12/h3-6,8-9,11,13H,1,7,10,15H2,2H3,(H,16,17)/t11?,13-/m1/s1
InChIKeyGPYHBXUNHGEQNF-GLGOKHISSA-N
MW232.33 g/mol
LogP1.64
Rot. Bonds6

About (2R)-2-amino-N-pent-4-en-2-yl-3-phenylpropanamide

(2R)-2-amino-N-pent-4-en-2-yl-3-phenylpropanamide (PubChem CID 103797386) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is (2R)-2-amino-N-pent-4-en-2-yl-3-phenylpropanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-pent-4-en-2-yl-3-phenylpropanamide
PubChem CID103797386
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC Name(2R)-2-amino-N-pent-4-en-2-yl-3-phenylpropanamide
SMILESC=CCC(C)NC(=O)[C@H](N)Cc1ccccc1
InChIInChI=1S/C14H20N2O/c1-3-7-11(2)16-14(17)13(15)10-12-8-5-4-6-9-12/h3-6,8-9,11,13H,1,7,10,15H2,2H3,(H,16,17)/t11?,13-/m1/s1
InChIKeyGPYHBXUNHGEQNF-GLGOKHISSA-N
XLogP1.64
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

(2R)-2-amino-N-butan-2-yl-3-phenylpropanamide
CID 78985447
benzyl N-pent-4-en-2-ylcarbamate
CID 50916610
2-amino-3-phenyl-N-propan-2-ylpropanamide
CID 15926064
2-amino-N-(1-ethylsulfanylpropan-2-yl)-3-phenylpropanamide
CID 113264230
(2S)-2-amino-N-(1-cyclopropylpropan-2-yl)-3-phenylpropanamide
CID 78955758
2-amino-N-(1-methylsulfinylpropan-2-yl)-3-phenylpropanamide
CID 113486466
(2R)-2-amino-N-octan-2-yl-3-phenylpropanamide
CID 78985477
2-amino-N-octan-2-yl-3-phenylpropanamide
CID 43711429
2-amino-3-phenyl-N-(1-phenylethyl)propanamide
CID 24709310
(2S)-2-amino-N-(1-phenylpropan-2-yl)butanamide
CID 79022695
methyl (2S)-2-[[(2S)-2-amino-3-phenylpropanoyl]amino]-3-methylbutanoate
CID 11771430
(2S)-N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-2-methylpent-4-enamide
CID 10857796

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-pent-4-en-2-yl-3-phenylpropanamide?
The IUPAC name of (2R)-2-amino-N-pent-4-en-2-yl-3-phenylpropanamide (CID 103797386) is (2R)-2-amino-N-pent-4-en-2-yl-3-phenylpropanamide.
What is the SMILES notation for (2R)-2-amino-N-pent-4-en-2-yl-3-phenylpropanamide?
The canonical SMILES for (2R)-2-amino-N-pent-4-en-2-yl-3-phenylpropanamide is C=CCC(C)NC(=O)[C@H](N)Cc1ccccc1.
What is the InChIKey of (2R)-2-amino-N-pent-4-en-2-yl-3-phenylpropanamide?
The InChIKey is GPYHBXUNHGEQNF-GLGOKHISSA-N. The full InChI is InChI=1S/C14H20N2O/c1-3-7-11(2)16-14(17)13(15)10-12-8-5-4-6-9-12/h3-6,8-9,11,13H,1,7,10,15H2,2H3,(H,16,17)/t11?,13-/m1/s1.
What are the key properties of (2R)-2-amino-N-pent-4-en-2-yl-3-phenylpropanamide?
(2R)-2-amino-N-pent-4-en-2-yl-3-phenylpropanamide has a molecular weight of 232.33 g/mol, XLogP of 1.64, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-pent-4-en-2-yl-3-phenylpropanamide is sourced from PubChem (CID 103797386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).