N-[(4-methoxyphenyl)-phenylmethyl]-2,2-diphenylpropanamide

C29H27NO2 — CID 5198788

IUPACN-[(4-methoxyphenyl)-phenylmethyl]-2,2-diphenylpropanamide
SMILESCOc1ccc(C(NC(=O)C(C)(c2ccccc2)c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C29H27NO2/c1-29(24-14-8-4-9-15-24,25-16-10-5-11-17-25)28(31)30-27(22-12-6-3-7-13-22)23-18-20-26(32-2)21-19-23/h3-21,27H,1-2H3,(H,30,31)
InChIKeyOGCLMFYFEZGLDB-UHFFFAOYSA-N
MW421.54 g/mol
LogP5.91
Rot. Bonds7

About N-[(4-methoxyphenyl)-phenylmethyl]-2,2-diphenylpropanamide

N-[(4-methoxyphenyl)-phenylmethyl]-2,2-diphenylpropanamide (PubChem CID 5198788) has the molecular formula C29H27NO2 and a molecular weight of 421.54 g/mol. Its IUPAC name is N-[(4-methoxyphenyl)-phenylmethyl]-2,2-diphenylpropanamide.

Molecular Properties

Compound NameN-[(4-methoxyphenyl)-phenylmethyl]-2,2-diphenylpropanamide
PubChem CID5198788
Molecular FormulaC29H27NO2
Molecular Weight421.54 g/mol
Exact Mass421.20
IUPAC NameN-[(4-methoxyphenyl)-phenylmethyl]-2,2-diphenylpropanamide
SMILESCOc1ccc(C(NC(=O)C(C)(c2ccccc2)c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C29H27NO2/c1-29(24-14-8-4-9-15-24,25-16-10-5-11-17-25)28(31)30-27(22-12-6-3-7-13-22)23-18-20-26(32-2)21-19-23/h3-21,27H,1-2H3,(H,30,31)
InChIKeyOGCLMFYFEZGLDB-UHFFFAOYSA-N
XLogP5.91
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500421.54
LogP ≤ 55.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,2-difluoro-N-[(S)-(4-methoxyphenyl)-phenylmethyl]-2-phenylacetamide
CID 51950712
[(S)-(4-methoxyphenyl)-phenylmethyl]urea
CID 870966
2,2-diphenyl-N-(1-phenylethyl)propanamide
CID 2939416
N-[(4-methoxyphenyl)-phenylmethyl]-2-methylpropanamide
CID 46419913
[2-[[(S)-(4-methoxyphenyl)-phenylmethyl]amino]-2-oxoethyl] 2-methyl-2-phenylpropanoate
CID 8608961
phenyl N-[(4-methoxyphenyl)-phenylmethyl]carbamate
CID 101077412
N-[(S)-(4-methoxyphenyl)-phenylmethyl]-3-phenylpropanamide
CID 891641
2-anilino-N-[bis(4-methoxyphenyl)methyl]acetamide
CID 18197509
1-benzhydryl-3-(4-methoxyphenyl)urea
CID 11602403
N-[(R)-(4-methoxyphenyl)-phenylmethyl]-2-methylbenzamide
CID 976350
N-[(4-methoxyphenyl)-phenylmethyl]-2-methylbenzamide
CID 2949574
4-methoxy-N-[(R)-(4-methylphenyl)-phenylmethyl]benzamide
CID 26174053

Frequently Asked Questions

What is the IUPAC name of N-[(4-methoxyphenyl)-phenylmethyl]-2,2-diphenylpropanamide?
The IUPAC name of N-[(4-methoxyphenyl)-phenylmethyl]-2,2-diphenylpropanamide (CID 5198788) is N-[(4-methoxyphenyl)-phenylmethyl]-2,2-diphenylpropanamide.
What is the SMILES notation for N-[(4-methoxyphenyl)-phenylmethyl]-2,2-diphenylpropanamide?
The canonical SMILES for N-[(4-methoxyphenyl)-phenylmethyl]-2,2-diphenylpropanamide is COc1ccc(C(NC(=O)C(C)(c2ccccc2)c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of N-[(4-methoxyphenyl)-phenylmethyl]-2,2-diphenylpropanamide?
The InChIKey is OGCLMFYFEZGLDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H27NO2/c1-29(24-14-8-4-9-15-24,25-16-10-5-11-17-25)28(31)30-27(22-12-6-3-7-13-22)23-18-20-26(32-2)21-19-23/h3-21,27H,1-2H3,(H,30,31).
What are the key properties of N-[(4-methoxyphenyl)-phenylmethyl]-2,2-diphenylpropanamide?
N-[(4-methoxyphenyl)-phenylmethyl]-2,2-diphenylpropanamide has a molecular weight of 421.54 g/mol, XLogP of 5.91, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methoxyphenyl)-phenylmethyl]-2,2-diphenylpropanamide is sourced from PubChem (CID 5198788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).