2-amino-N-ethyl-3-phenylpropanamide;hydrochloride

C11H17ClN2O — CID 53409094

IUPAC2-amino-N-ethyl-3-phenylpropanamide;hydrochloride
SMILESCCNC(=O)C(N)Cc1ccccc1.Cl
InChIInChI=1S/C11H16N2O.ClH/c1-2-13-11(14)10(12)8-9-6-4-3-5-7-9;/h3-7,10H,2,8,12H2,1H3,(H,13,14);1H
InChIKeyQEWGCJHKZJVFFG-UHFFFAOYSA-N
MW228.72 g/mol
LogP1.11
Rot. Bonds4

About 2-amino-N-ethyl-3-phenylpropanamide;hydrochloride

2-amino-N-ethyl-3-phenylpropanamide;hydrochloride (PubChem CID 53409094) has the molecular formula C11H17ClN2O and a molecular weight of 228.72 g/mol. Its IUPAC name is 2-amino-N-ethyl-3-phenylpropanamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-ethyl-3-phenylpropanamide;hydrochloride
PubChem CID53409094
Molecular FormulaC11H17ClN2O
Molecular Weight228.72 g/mol
Exact Mass228.10
IUPAC Name2-amino-N-ethyl-3-phenylpropanamide;hydrochloride
SMILESCCNC(=O)C(N)Cc1ccccc1.Cl
InChIInChI=1S/C11H16N2O.ClH/c1-2-13-11(14)10(12)8-9-6-4-3-5-7-9;/h3-7,10H,2,8,12H2,1H3,(H,13,14);1H
InChIKeyQEWGCJHKZJVFFG-UHFFFAOYSA-N
XLogP1.11
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.72
LogP ≤ 51.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-N-ethyl-3-phenylpropanamide;2,2,2-trifluoroacetic acid
CID 70927054
2-amino-N-[2-(ethylamino)-2-oxoethyl]-3-phenylpropanamide;hydrochloride
CID 119271418
(2S)-2-amino-3-phenyl-N-(2-phenylethyl)propanamide;hydrochloride
CID 21308260
(2S)-2-amino-N-(3,3-dimethylbutyl)-3-phenylpropanamide;hydrochloride
CID 119279534
methyl 2-[(2-amino-3-phenylpropanoyl)amino]acetate;hydrochloride
CID 70536433
2-amino-N-(2-methylbutyl)-3-phenylpropanamide
CID 55108121
methyl 2-[[(2S)-2-amino-3-phenylpropanoyl]amino]acetate;hydrochloride
CID 13131506
2-amino-N-decyl-3-phenylpropanamide
CID 122423651
ethyl 3-[(2-amino-3-phenylpropanoyl)amino]propanoate;hydrochloride
CID 119281055
(2S)-2-amino-N-(3-methylbutyl)-3-phenylpropanamide
CID 10399143
(2S)-2-amino-N-[2-[2-[[(2S)-2-amino-3-phenylpropanoyl]amino]ethyldisulfanyl]ethyl]-3-phenylpropanamide
CID 10388888
(2R)-2-amino-N-but-2-ynyl-3-phenylpropanamide
CID 104861124

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-ethyl-3-phenylpropanamide;hydrochloride?
The IUPAC name of 2-amino-N-ethyl-3-phenylpropanamide;hydrochloride (CID 53409094) is 2-amino-N-ethyl-3-phenylpropanamide;hydrochloride.
What is the SMILES notation for 2-amino-N-ethyl-3-phenylpropanamide;hydrochloride?
The canonical SMILES for 2-amino-N-ethyl-3-phenylpropanamide;hydrochloride is CCNC(=O)C(N)Cc1ccccc1.Cl.
What is the InChIKey of 2-amino-N-ethyl-3-phenylpropanamide;hydrochloride?
The InChIKey is QEWGCJHKZJVFFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O.ClH/c1-2-13-11(14)10(12)8-9-6-4-3-5-7-9;/h3-7,10H,2,8,12H2,1H3,(H,13,14);1H.
What are the key properties of 2-amino-N-ethyl-3-phenylpropanamide;hydrochloride?
2-amino-N-ethyl-3-phenylpropanamide;hydrochloride has a molecular weight of 228.72 g/mol, XLogP of 1.11, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-ethyl-3-phenylpropanamide;hydrochloride is sourced from PubChem (CID 53409094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).