N-[(2-chlorophenyl)methyl]-2-(4-phenylphenoxy)propanamide

C22H20ClNO2 — CID 17194172

IUPACN-[(2-chlorophenyl)methyl]-2-(4-phenylphenoxy)propanamide
SMILESCC(Oc1ccc(-c2ccccc2)cc1)C(=O)NCc1ccccc1Cl
InChIInChI=1S/C22H20ClNO2/c1-16(22(25)24-15-19-9-5-6-10-21(19)23)26-20-13-11-18(12-14-20)17-7-3-2-4-8-17/h2-14,16H,15H2,1H3,(H,24,25)
InChIKeyDSJROMMHUMYXLP-UHFFFAOYSA-N
MW365.86 g/mol
LogP5.09
Rot. Bonds6

About N-[(2-chlorophenyl)methyl]-2-(4-phenylphenoxy)propanamide

N-[(2-chlorophenyl)methyl]-2-(4-phenylphenoxy)propanamide (PubChem CID 17194172) has the molecular formula C22H20ClNO2 and a molecular weight of 365.86 g/mol. Its IUPAC name is N-[(2-chlorophenyl)methyl]-2-(4-phenylphenoxy)propanamide.

Molecular Properties

Compound NameN-[(2-chlorophenyl)methyl]-2-(4-phenylphenoxy)propanamide
PubChem CID17194172
Molecular FormulaC22H20ClNO2
Molecular Weight365.86 g/mol
Exact Mass365.12
IUPAC NameN-[(2-chlorophenyl)methyl]-2-(4-phenylphenoxy)propanamide
SMILESCC(Oc1ccc(-c2ccccc2)cc1)C(=O)NCc1ccccc1Cl
InChIInChI=1S/C22H20ClNO2/c1-16(22(25)24-15-19-9-5-6-10-21(19)23)26-20-13-11-18(12-14-20)17-7-3-2-4-8-17/h2-14,16H,15H2,1H3,(H,24,25)
InChIKeyDSJROMMHUMYXLP-UHFFFAOYSA-N
XLogP5.09
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500365.86
LogP ≤ 55.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2-chlorophenyl)methyl]-2-(4-iodophenoxy)propanamide
CID 24511812
2-(4-acetylphenoxy)-N-[(2-chlorophenyl)methyl]propanamide
CID 17399319
(2S)-N-[(2-chlorophenyl)methyl]-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]propanamide
CID 8851774
(2S)-2-(3-chlorophenoxy)-N-[(2-chlorophenyl)methyl]propanamide
CID 894862
N-[(2-chlorophenyl)methyl]-2-(3-methylphenoxy)propanamide
CID 6915501
(2R)-N-[(2-chlorophenyl)methyl]-2-[4-[methyl(methylsulfonyl)amino]phenoxy]propanamide
CID 100656988
N-[(2-hydroxyphenyl)methyl]-2-phenoxypropanamide
CID 60607631
2-(4-methylphenoxy)-N-[(2-methylphenyl)methyl]propanamide
CID 46807295
N-(2,3-dichlorophenyl)-2-(4-phenylphenoxy)propanamide
CID 4951768
(2R)-N-[(2-methylphenyl)methyl]-2-phenoxypropanamide
CID 41013253
N-[2-(ethylamino)ethyl]-2-(4-phenylphenoxy)propanamide
CID 119509338
N-[2-[2-(4-phenylphenoxy)propanoylamino]ethyl]benzamide
CID 46686897

Frequently Asked Questions

What is the IUPAC name of N-[(2-chlorophenyl)methyl]-2-(4-phenylphenoxy)propanamide?
The IUPAC name of N-[(2-chlorophenyl)methyl]-2-(4-phenylphenoxy)propanamide (CID 17194172) is N-[(2-chlorophenyl)methyl]-2-(4-phenylphenoxy)propanamide.
What is the SMILES notation for N-[(2-chlorophenyl)methyl]-2-(4-phenylphenoxy)propanamide?
The canonical SMILES for N-[(2-chlorophenyl)methyl]-2-(4-phenylphenoxy)propanamide is CC(Oc1ccc(-c2ccccc2)cc1)C(=O)NCc1ccccc1Cl.
What is the InChIKey of N-[(2-chlorophenyl)methyl]-2-(4-phenylphenoxy)propanamide?
The InChIKey is DSJROMMHUMYXLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20ClNO2/c1-16(22(25)24-15-19-9-5-6-10-21(19)23)26-20-13-11-18(12-14-20)17-7-3-2-4-8-17/h2-14,16H,15H2,1H3,(H,24,25).
What are the key properties of N-[(2-chlorophenyl)methyl]-2-(4-phenylphenoxy)propanamide?
N-[(2-chlorophenyl)methyl]-2-(4-phenylphenoxy)propanamide has a molecular weight of 365.86 g/mol, XLogP of 5.09, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-chlorophenyl)methyl]-2-(4-phenylphenoxy)propanamide is sourced from PubChem (CID 17194172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).