2-amino-N-[1-(4-chlorophenyl)propyl]-2-phenylacetamide

C17H19ClN2O — CID 43704192

IUPAC2-amino-N-[1-(4-chlorophenyl)propyl]-2-phenylacetamide
SMILESCCC(NC(=O)C(N)c1ccccc1)c1ccc(Cl)cc1
InChIInChI=1S/C17H19ClN2O/c1-2-15(12-8-10-14(18)11-9-12)20-17(21)16(19)13-6-4-3-5-7-13/h3-11,15-16H,2,19H2,1H3,(H,20,21)
InChIKeyMLQRXTVRRVJTCZ-UHFFFAOYSA-N
MW302.81 g/mol
LogP3.61
Rot. Bonds5

About 2-amino-N-[1-(4-chlorophenyl)propyl]-2-phenylacetamide

2-amino-N-[1-(4-chlorophenyl)propyl]-2-phenylacetamide (PubChem CID 43704192) has the molecular formula C17H19ClN2O and a molecular weight of 302.81 g/mol. Its IUPAC name is 2-amino-N-[1-(4-chlorophenyl)propyl]-2-phenylacetamide.

Molecular Properties

Compound Name2-amino-N-[1-(4-chlorophenyl)propyl]-2-phenylacetamide
PubChem CID43704192
Molecular FormulaC17H19ClN2O
Molecular Weight302.81 g/mol
Exact Mass302.12
IUPAC Name2-amino-N-[1-(4-chlorophenyl)propyl]-2-phenylacetamide
SMILESCCC(NC(=O)C(N)c1ccccc1)c1ccc(Cl)cc1
InChIInChI=1S/C17H19ClN2O/c1-2-15(12-8-10-14(18)11-9-12)20-17(21)16(19)13-6-4-3-5-7-13/h3-11,15-16H,2,19H2,1H3,(H,20,21)
InChIKeyMLQRXTVRRVJTCZ-UHFFFAOYSA-N
XLogP3.61
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.81
LogP ≤ 53.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(3S)-3-amino-N-[(1S)-1-(4-chlorophenyl)propyl]-3-phenylpropanamide
CID 124684118
(2S)-2-amino-N-[1-(4-chlorophenyl)ethyl]-2-phenylacetamide
CID 104897669
2-(4-chlorophenoxy)-N-(1-phenylpropyl)propanamide
CID 43911516
2-amino-N-(2-hydroxy-1-phenylethyl)-2-phenylacetamide
CID 63183868
4-[1-(4-chlorophenyl)propylamino]-2,3-dimethyl-4-oxobutanoic acid
CID 103497036
methyl 4-[(1R)-1-[[2-amino-2-(3-chlorophenyl)acetyl]amino]propyl]benzoate
CID 71243030
N-[1-(4-chlorophenyl)propyl]-3-phenylbutanamide
CID 24613384
(3S)-3-(4-chlorophenyl)-3-(2-phenylbutanoylamino)propanoic acid
CID 120606635
(3S)-3-(4-chlorophenyl)-3-[[(2R)-2-phenylbutanoyl]amino]propanoic acid
CID 7045314
4-[1-amino-2-oxo-2-[[(1S)-1-phenylpropyl]amino]ethyl]-N-pyridin-4-ylbenzamide
CID 15983905
3-amino-N-[1-(4-chlorophenyl)propyl]propanamide;hydrochloride
CID 119276743
2-amino-3-methyl-N-(1-phenylpropyl)pentanamide
CID 62305056

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[1-(4-chlorophenyl)propyl]-2-phenylacetamide?
The IUPAC name of 2-amino-N-[1-(4-chlorophenyl)propyl]-2-phenylacetamide (CID 43704192) is 2-amino-N-[1-(4-chlorophenyl)propyl]-2-phenylacetamide.
What is the SMILES notation for 2-amino-N-[1-(4-chlorophenyl)propyl]-2-phenylacetamide?
The canonical SMILES for 2-amino-N-[1-(4-chlorophenyl)propyl]-2-phenylacetamide is CCC(NC(=O)C(N)c1ccccc1)c1ccc(Cl)cc1.
What is the InChIKey of 2-amino-N-[1-(4-chlorophenyl)propyl]-2-phenylacetamide?
The InChIKey is MLQRXTVRRVJTCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19ClN2O/c1-2-15(12-8-10-14(18)11-9-12)20-17(21)16(19)13-6-4-3-5-7-13/h3-11,15-16H,2,19H2,1H3,(H,20,21).
What are the key properties of 2-amino-N-[1-(4-chlorophenyl)propyl]-2-phenylacetamide?
2-amino-N-[1-(4-chlorophenyl)propyl]-2-phenylacetamide has a molecular weight of 302.81 g/mol, XLogP of 3.61, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[1-(4-chlorophenyl)propyl]-2-phenylacetamide is sourced from PubChem (CID 43704192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).