N-[(4-methoxyphenyl)-phenylmethyl]-2-methylbenzamide

C22H21NO2 — CID 2949574

IUPACN-[(4-methoxyphenyl)-phenylmethyl]-2-methylbenzamide
SMILESCOc1ccc(C(NC(=O)c2ccccc2C)c2ccccc2)cc1
InChIInChI=1S/C22H21NO2/c1-16-8-6-7-11-20(16)22(24)23-21(17-9-4-3-5-10-17)18-12-14-19(25-2)15-13-18/h3-15,21H,1-2H3,(H,23,24)
InChIKeyNASBPWOPQROGDF-UHFFFAOYSA-N
MW331.42 g/mol
LogP4.52
Rot. Bonds5

About N-[(4-methoxyphenyl)-phenylmethyl]-2-methylbenzamide

N-[(4-methoxyphenyl)-phenylmethyl]-2-methylbenzamide (PubChem CID 2949574) has the molecular formula C22H21NO2 and a molecular weight of 331.42 g/mol. Its IUPAC name is N-[(4-methoxyphenyl)-phenylmethyl]-2-methylbenzamide.

Molecular Properties

Compound NameN-[(4-methoxyphenyl)-phenylmethyl]-2-methylbenzamide
PubChem CID2949574
Molecular FormulaC22H21NO2
Molecular Weight331.42 g/mol
Exact Mass331.16
IUPAC NameN-[(4-methoxyphenyl)-phenylmethyl]-2-methylbenzamide
SMILESCOc1ccc(C(NC(=O)c2ccccc2C)c2ccccc2)cc1
InChIInChI=1S/C22H21NO2/c1-16-8-6-7-11-20(16)22(24)23-21(17-9-4-3-5-10-17)18-12-14-19(25-2)15-13-18/h3-15,21H,1-2H3,(H,23,24)
InChIKeyNASBPWOPQROGDF-UHFFFAOYSA-N
XLogP4.52
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 ≤ 54.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(R)-(4-methoxyphenyl)-phenylmethyl]-2-methylbenzamide
CID 976350
N-[(4-methoxyphenyl)-phenylmethyl]-2,6-dimethylpyridine-3-carboxamide
CID 55875751
2,5-dimethoxy-N-[(S)-(4-methoxyphenyl)-phenylmethyl]benzamide
CID 9118748
N-[(1S)-1-(4-methoxyphenyl)propyl]-2-methylbenzamide
CID 28979661
4-methoxy-N-[(R)-(4-methylphenyl)-phenylmethyl]benzamide
CID 26174053
2,5-dichloro-N-[(4-methoxyphenyl)-phenylmethyl]benzamide
CID 16559317
2-methyl-N-[(R)-(2-methylphenyl)-phenylmethyl]benzamide
CID 28578946
[(S)-(4-methoxyphenyl)-phenylmethyl]urea
CID 870966
2,3,4,5,6-pentafluoro-N-[(R)-(4-methoxyphenyl)-phenylmethyl]benzamide
CID 2190610
ethyl 3-(4-methoxyphenyl)-3-[(2-methylbenzoyl)amino]propanoate
CID 4042935
N-[(4-methoxyphenyl)-phenylmethyl]-2-methylpropanamide
CID 46419913
N-[(2S)-1-(4-methoxyanilino)-1-oxopropan-2-yl]-2-methylbenzamide
CID 92664875

Frequently Asked Questions

What is the IUPAC name of N-[(4-methoxyphenyl)-phenylmethyl]-2-methylbenzamide?
The IUPAC name of N-[(4-methoxyphenyl)-phenylmethyl]-2-methylbenzamide (CID 2949574) is N-[(4-methoxyphenyl)-phenylmethyl]-2-methylbenzamide.
What is the SMILES notation for N-[(4-methoxyphenyl)-phenylmethyl]-2-methylbenzamide?
The canonical SMILES for N-[(4-methoxyphenyl)-phenylmethyl]-2-methylbenzamide is COc1ccc(C(NC(=O)c2ccccc2C)c2ccccc2)cc1.
What is the InChIKey of N-[(4-methoxyphenyl)-phenylmethyl]-2-methylbenzamide?
The InChIKey is NASBPWOPQROGDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21NO2/c1-16-8-6-7-11-20(16)22(24)23-21(17-9-4-3-5-10-17)18-12-14-19(25-2)15-13-18/h3-15,21H,1-2H3,(H,23,24).
What are the key properties of N-[(4-methoxyphenyl)-phenylmethyl]-2-methylbenzamide?
N-[(4-methoxyphenyl)-phenylmethyl]-2-methylbenzamide has a molecular weight of 331.42 g/mol, XLogP of 4.52, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methoxyphenyl)-phenylmethyl]-2-methylbenzamide is sourced from PubChem (CID 2949574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).