3-(3-chlorophenyl)-N-(2-phenylethyl)propanamide

C17H18ClNO — CID 1407340

IUPAC3-(3-chlorophenyl)-N-(2-phenylethyl)propanamide
SMILESO=C(CCc1cccc(Cl)c1)NCCc1ccccc1
InChIInChI=1S/C17H18ClNO/c18-16-8-4-7-15(13-16)9-10-17(20)19-12-11-14-5-2-1-3-6-14/h1-8,13H,9-12H2,(H,19,20)
InChIKeyGHJDPILHSBPCPF-UHFFFAOYSA-N
MW287.79 g/mol
LogP3.63
Rot. Bonds6

About 3-(3-chlorophenyl)-N-(2-phenylethyl)propanamide

3-(3-chlorophenyl)-N-(2-phenylethyl)propanamide (PubChem CID 1407340) has the molecular formula C17H18ClNO and a molecular weight of 287.79 g/mol. Its IUPAC name is 3-(3-chlorophenyl)-N-(2-phenylethyl)propanamide.

Molecular Properties

Compound Name3-(3-chlorophenyl)-N-(2-phenylethyl)propanamide
PubChem CID1407340
Molecular FormulaC17H18ClNO
Molecular Weight287.79 g/mol
Exact Mass287.11
IUPAC Name3-(3-chlorophenyl)-N-(2-phenylethyl)propanamide
SMILESO=C(CCc1cccc(Cl)c1)NCCc1ccccc1
InChIInChI=1S/C17H18ClNO/c18-16-8-4-7-15(13-16)9-10-17(20)19-12-11-14-5-2-1-3-6-14/h1-8,13H,9-12H2,(H,19,20)
InChIKeyGHJDPILHSBPCPF-UHFFFAOYSA-N
XLogP3.63
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.79
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N,N'-bis[2-(3-chlorophenyl)ethyl]butanediamide
CID 2166305
3-(3-aminophenyl)-N-[2-(3-chlorophenyl)ethyl]propanamide
CID 28713453
6-[2-(3-chlorophenyl)ethylamino]-6-oxohexanoic acid
CID 43579976
N-(2-aminoethyl)-3-(3-chlorophenyl)propanamide
CID 94684838
N-[2-(3-chlorophenyl)ethyl]-3-phenoxypropanamide
CID 113098409
3-(3-chlorophenyl)-N-(3-hydroxy-3-phenylpropyl)propanamide
CID 111472067
3-(benzenesulfonyl)-N-[2-(3-chlorophenyl)ethyl]propanamide
CID 32816816
3-(3-chlorophenyl)-N-(2-pyridin-2-ylethyl)propanamide
CID 47141858
2-(benzylamino)-N-[2-(3-chlorophenyl)ethyl]acetamide
CID 108996409
N-[2-(3-chlorophenyl)ethyl]-3-cyanopropanamide
CID 94686976
methyl 4-[2-(3-chlorophenyl)ethylamino]-4-oxobutanoate
CID 94696577
3-(3-chlorophenyl)-N-phenylpropanamide
CID 1407295

Frequently Asked Questions

What is the IUPAC name of 3-(3-chlorophenyl)-N-(2-phenylethyl)propanamide?
The IUPAC name of 3-(3-chlorophenyl)-N-(2-phenylethyl)propanamide (CID 1407340) is 3-(3-chlorophenyl)-N-(2-phenylethyl)propanamide.
What is the SMILES notation for 3-(3-chlorophenyl)-N-(2-phenylethyl)propanamide?
The canonical SMILES for 3-(3-chlorophenyl)-N-(2-phenylethyl)propanamide is O=C(CCc1cccc(Cl)c1)NCCc1ccccc1.
What is the InChIKey of 3-(3-chlorophenyl)-N-(2-phenylethyl)propanamide?
The InChIKey is GHJDPILHSBPCPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18ClNO/c18-16-8-4-7-15(13-16)9-10-17(20)19-12-11-14-5-2-1-3-6-14/h1-8,13H,9-12H2,(H,19,20).
What are the key properties of 3-(3-chlorophenyl)-N-(2-phenylethyl)propanamide?
3-(3-chlorophenyl)-N-(2-phenylethyl)propanamide has a molecular weight of 287.79 g/mol, XLogP of 3.63, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-chlorophenyl)-N-(2-phenylethyl)propanamide is sourced from PubChem (CID 1407340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).