(2R)-2-amino-N-[2-(4-chlorophenyl)ethyl]propanamide

C11H15ClN2O — CID 78973575

IUPAC(2R)-2-amino-N-[2-(4-chlorophenyl)ethyl]propanamide
SMILESC[C@@H](N)C(=O)NCCc1ccc(Cl)cc1
InChIInChI=1S/C11H15ClN2O/c1-8(13)11(15)14-7-6-9-2-4-10(12)5-3-9/h2-5,8H,6-7,13H2,1H3,(H,14,15)/t8-/m1/s1
InChIKeyIZTNBIFZGCJBCL-MRVPVSSYSA-N
MW226.71 g/mol
LogP1.35
Rot. Bonds4

About (2R)-2-amino-N-[2-(4-chlorophenyl)ethyl]propanamide

(2R)-2-amino-N-[2-(4-chlorophenyl)ethyl]propanamide (PubChem CID 78973575) has the molecular formula C11H15ClN2O and a molecular weight of 226.71 g/mol. Its IUPAC name is (2R)-2-amino-N-[2-(4-chlorophenyl)ethyl]propanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-[2-(4-chlorophenyl)ethyl]propanamide
PubChem CID78973575
Molecular FormulaC11H15ClN2O
Molecular Weight226.71 g/mol
Exact Mass226.09
IUPAC Name(2R)-2-amino-N-[2-(4-chlorophenyl)ethyl]propanamide
SMILESC[C@@H](N)C(=O)NCCc1ccc(Cl)cc1
InChIInChI=1S/C11H15ClN2O/c1-8(13)11(15)14-7-6-9-2-4-10(12)5-3-9/h2-5,8H,6-7,13H2,1H3,(H,14,15)/t8-/m1/s1
InChIKeyIZTNBIFZGCJBCL-MRVPVSSYSA-N
XLogP1.35
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 ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-N-[2-(4-chlorophenyl)ethyl]-3-methylbutanamide;hydrochloride
CID 119263480
(2S)-2-amino-N-[2-(4-methylphenyl)ethyl]propanamide;hydrochloride
CID 119326870
(2R)-2-amino-N-[2-(4-methylphenyl)ethyl]propanamide;hydrochloride
CID 119326879
(2R)-2-amino-N-[2-(4-chlorophenyl)ethyl]butanediamide
CID 83340796
2-amino-N-[2-(4-methoxyphenyl)ethyl]propanamide
CID 24710031
(2S)-2-amino-N-[2-(3-bromo-4-fluorophenyl)ethyl]propanamide
CID 119299748
4-amino-5-[2-(4-chlorophenyl)ethylamino]-5-oxopentanoic acid
CID 64890887
(2R)-2-amino-3-(4-chlorophenyl)-N-(2-phenylethyl)propanamide
CID 70832630
(2R)-2-amino-N-[2-(3-bromo-4-fluorophenyl)ethyl]propanamide
CID 119299762
4-[2-(4-chlorophenyl)ethylamino]-2-methyl-4-oxobutanoic acid
CID 115165161
(2R)-2-bromo-N-[2-(4-chlorophenyl)ethyl]butanamide
CID 92864169
(2S)-2-amino-N-[3-(4-propan-2-ylphenyl)propyl]propanamide
CID 119322585

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-[2-(4-chlorophenyl)ethyl]propanamide?
The IUPAC name of (2R)-2-amino-N-[2-(4-chlorophenyl)ethyl]propanamide (CID 78973575) is (2R)-2-amino-N-[2-(4-chlorophenyl)ethyl]propanamide.
What is the SMILES notation for (2R)-2-amino-N-[2-(4-chlorophenyl)ethyl]propanamide?
The canonical SMILES for (2R)-2-amino-N-[2-(4-chlorophenyl)ethyl]propanamide is C[C@@H](N)C(=O)NCCc1ccc(Cl)cc1.
What is the InChIKey of (2R)-2-amino-N-[2-(4-chlorophenyl)ethyl]propanamide?
The InChIKey is IZTNBIFZGCJBCL-MRVPVSSYSA-N. The full InChI is InChI=1S/C11H15ClN2O/c1-8(13)11(15)14-7-6-9-2-4-10(12)5-3-9/h2-5,8H,6-7,13H2,1H3,(H,14,15)/t8-/m1/s1.
What are the key properties of (2R)-2-amino-N-[2-(4-chlorophenyl)ethyl]propanamide?
(2R)-2-amino-N-[2-(4-chlorophenyl)ethyl]propanamide has a molecular weight of 226.71 g/mol, XLogP of 1.35, 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-[2-(4-chlorophenyl)ethyl]propanamide is sourced from PubChem (CID 78973575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).