2-(3-chlorophenoxy)-N-[(2-methylphenyl)-phenylmethyl]propanamide

C23H22ClNO2 — CID 46772545

IUPAC2-(3-chlorophenoxy)-N-[(2-methylphenyl)-phenylmethyl]propanamide
SMILESCc1ccccc1C(NC(=O)C(C)Oc1cccc(Cl)c1)c1ccccc1
InChIInChI=1S/C23H22ClNO2/c1-16-9-6-7-14-21(16)22(18-10-4-3-5-11-18)25-23(26)17(2)27-20-13-8-12-19(24)15-20/h3-15,17,22H,1-2H3,(H,25,26)
InChIKeyBBBDRPPPFFWYJV-UHFFFAOYSA-N
MW379.89 g/mol
LogP5.32
Rot. Bonds6

About 2-(3-chlorophenoxy)-N-[(2-methylphenyl)-phenylmethyl]propanamide

2-(3-chlorophenoxy)-N-[(2-methylphenyl)-phenylmethyl]propanamide (PubChem CID 46772545) has the molecular formula C23H22ClNO2 and a molecular weight of 379.89 g/mol. Its IUPAC name is 2-(3-chlorophenoxy)-N-[(2-methylphenyl)-phenylmethyl]propanamide.

Molecular Properties

Compound Name2-(3-chlorophenoxy)-N-[(2-methylphenyl)-phenylmethyl]propanamide
PubChem CID46772545
Molecular FormulaC23H22ClNO2
Molecular Weight379.89 g/mol
Exact Mass379.13
IUPAC Name2-(3-chlorophenoxy)-N-[(2-methylphenyl)-phenylmethyl]propanamide
SMILESCc1ccccc1C(NC(=O)C(C)Oc1cccc(Cl)c1)c1ccccc1
InChIInChI=1S/C23H22ClNO2/c1-16-9-6-7-14-21(16)22(18-10-4-3-5-11-18)25-23(26)17(2)27-20-13-8-12-19(24)15-20/h3-15,17,22H,1-2H3,(H,25,26)
InChIKeyBBBDRPPPFFWYJV-UHFFFAOYSA-N
XLogP5.32
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500379.89
LogP ≤ 55.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2-methylphenyl)-phenylmethyl]-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propanamide
CID 133162624
2-methyl-N-[(S)-(2-methylphenyl)-phenylmethyl]propanamide
CID 100583680
N-benzhydryl-2-(4-chloro-3-methylphenoxy)propanamide
CID 132656978
N-benzhydryl-2-(3-methylphenoxy)propanamide
CID 15978225
(2S)-2-(3-chlorophenoxy)-N-[(1S)-3-methyl-1-phenylbutyl]propanamide
CID 92679279
(2R)-2-(3-chlorophenoxy)-N-[(1R)-3-methyl-1-phenylbutyl]propanamide
CID 92679276
(2S)-2-(3-chlorophenoxy)-N-pentan-3-ylpropanamide
CID 94087042
2-(3-chlorophenoxy)-N-(3-methylbutan-2-yl)propanamide
CID 78780294
ethyl 2-[2-(3-chlorophenoxy)propanoylamino]propanoate
CID 47368061
2-(3-chlorophenoxy)-N-[1-(2-methylphenoxy)propan-2-yl]propanamide
CID 132652826
(2S)-2-(3-methoxyphenoxy)-N-[(S)-(2-methylphenyl)-phenylmethyl]butanamide
CID 92673239
(2S)-2-(4-chlorophenoxy)-N-[(R)-(4-methylphenyl)-phenylmethyl]propanamide
CID 28580247

Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenoxy)-N-[(2-methylphenyl)-phenylmethyl]propanamide?
The IUPAC name of 2-(3-chlorophenoxy)-N-[(2-methylphenyl)-phenylmethyl]propanamide (CID 46772545) is 2-(3-chlorophenoxy)-N-[(2-methylphenyl)-phenylmethyl]propanamide.
What is the SMILES notation for 2-(3-chlorophenoxy)-N-[(2-methylphenyl)-phenylmethyl]propanamide?
The canonical SMILES for 2-(3-chlorophenoxy)-N-[(2-methylphenyl)-phenylmethyl]propanamide is Cc1ccccc1C(NC(=O)C(C)Oc1cccc(Cl)c1)c1ccccc1.
What is the InChIKey of 2-(3-chlorophenoxy)-N-[(2-methylphenyl)-phenylmethyl]propanamide?
The InChIKey is BBBDRPPPFFWYJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22ClNO2/c1-16-9-6-7-14-21(16)22(18-10-4-3-5-11-18)25-23(26)17(2)27-20-13-8-12-19(24)15-20/h3-15,17,22H,1-2H3,(H,25,26).
What are the key properties of 2-(3-chlorophenoxy)-N-[(2-methylphenyl)-phenylmethyl]propanamide?
2-(3-chlorophenoxy)-N-[(2-methylphenyl)-phenylmethyl]propanamide has a molecular weight of 379.89 g/mol, XLogP of 5.32, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenoxy)-N-[(2-methylphenyl)-phenylmethyl]propanamide is sourced from PubChem (CID 46772545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).