N-[1-(3-methoxyphenyl)ethyl]-2-phenylbenzamide

C22H21NO2 — CID 154835213

IUPACN-[1-(3-methoxyphenyl)ethyl]-2-phenylbenzamide
SMILESCOc1cccc(C(C)NC(=O)c2ccccc2-c2ccccc2)c1
InChIInChI=1S/C22H21NO2/c1-16(18-11-8-12-19(15-18)25-2)23-22(24)21-14-7-6-13-20(21)17-9-4-3-5-10-17/h3-16H,1-2H3,(H,23,24)
InChIKeyKYJHZQWSZPZLJA-UHFFFAOYSA-N
MW331.42 g/mol
LogP4.85
Rot. Bonds5

About N-[1-(3-methoxyphenyl)ethyl]-2-phenylbenzamide

N-[1-(3-methoxyphenyl)ethyl]-2-phenylbenzamide (PubChem CID 154835213) has the molecular formula C22H21NO2 and a molecular weight of 331.42 g/mol. Its IUPAC name is N-[1-(3-methoxyphenyl)ethyl]-2-phenylbenzamide.

Molecular Properties

Compound NameN-[1-(3-methoxyphenyl)ethyl]-2-phenylbenzamide
PubChem CID154835213
Molecular FormulaC22H21NO2
Molecular Weight331.42 g/mol
Exact Mass331.16
IUPAC NameN-[1-(3-methoxyphenyl)ethyl]-2-phenylbenzamide
SMILESCOc1cccc(C(C)NC(=O)c2ccccc2-c2ccccc2)c1
InChIInChI=1S/C22H21NO2/c1-16(18-11-8-12-19(15-18)25-2)23-22(24)21-14-7-6-13-20(21)17-9-4-3-5-10-17/h3-16H,1-2H3,(H,23,24)
InChIKeyKYJHZQWSZPZLJA-UHFFFAOYSA-N
XLogP4.85
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.42
LogP ≤ 54.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-bromo-N-[1-(3-methoxyphenyl)ethyl]benzamide
CID 17329704
2,3-dimethoxy-N-[(1S)-1-(3-methoxyphenyl)ethyl]benzamide
CID 842039
N-[1-[3-methoxy-4-(2-methoxyethoxy)phenyl]ethyl]-2-phenylbenzamide
CID 55748194
3-bromo-2-chloro-N-[1-(3-methoxyphenyl)ethyl]benzamide
CID 103985511
6-bromo-2-(3-methoxyphenyl)-N-[1-(3-methoxyphenyl)ethyl]quinoline-4-carboxamide
CID 3276685
2-(3,5-dimethoxyphenyl)-N-propan-2-ylbenzamide
CID 72846372
2-amino-N-[(1S)-1-(3-methoxyphenyl)ethyl]-5-methylbenzamide
CID 81355155
2-chloro-4,5-difluoro-N-[(1S)-1-(3-methoxyphenyl)ethyl]benzamide
CID 42563597
2-chloro-N-[1-(3-methoxyphenyl)ethyl]-2-phenylacetamide
CID 60934244
2,4-dimethoxy-N-[(1S)-1-phenylethyl]benzamide
CID 814199
(2R)-2-amino-N-[(1R)-1-(3-methoxyphenyl)ethyl]-2-phenylacetamide
CID 81354308
5-(3-methoxyphenyl)-2-methyl-1-phenyl-N-(1-phenylethyl)pyrrole-3-carboxamide
CID 42665947

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-methoxyphenyl)ethyl]-2-phenylbenzamide?
The IUPAC name of N-[1-(3-methoxyphenyl)ethyl]-2-phenylbenzamide (CID 154835213) is N-[1-(3-methoxyphenyl)ethyl]-2-phenylbenzamide.
What is the SMILES notation for N-[1-(3-methoxyphenyl)ethyl]-2-phenylbenzamide?
The canonical SMILES for N-[1-(3-methoxyphenyl)ethyl]-2-phenylbenzamide is COc1cccc(C(C)NC(=O)c2ccccc2-c2ccccc2)c1.
What is the InChIKey of N-[1-(3-methoxyphenyl)ethyl]-2-phenylbenzamide?
The InChIKey is KYJHZQWSZPZLJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21NO2/c1-16(18-11-8-12-19(15-18)25-2)23-22(24)21-14-7-6-13-20(21)17-9-4-3-5-10-17/h3-16H,1-2H3,(H,23,24).
What are the key properties of N-[1-(3-methoxyphenyl)ethyl]-2-phenylbenzamide?
N-[1-(3-methoxyphenyl)ethyl]-2-phenylbenzamide has a molecular weight of 331.42 g/mol, XLogP of 4.85, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-methoxyphenyl)ethyl]-2-phenylbenzamide is sourced from PubChem (CID 154835213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).