4-methoxy-N,N-dimethyl-3-phenylbenzamide

C16H17NO2 — CID 49375903

IUPAC4-methoxy-N,N-dimethyl-3-phenylbenzamide
SMILESCOc1ccc(C(=O)N(C)C)cc1-c1ccccc1
InChIInChI=1S/C16H17NO2/c1-17(2)16(18)13-9-10-15(19-3)14(11-13)12-7-5-4-6-8-12/h4-11H,1-3H3
InChIKeyWUVGVNYWHRSEQS-UHFFFAOYSA-N
MW255.32 g/mol
LogP3.06
Rot. Bonds3

About 4-methoxy-N,N-dimethyl-3-phenylbenzamide

4-methoxy-N,N-dimethyl-3-phenylbenzamide (PubChem CID 49375903) has the molecular formula C16H17NO2 and a molecular weight of 255.32 g/mol. Its IUPAC name is 4-methoxy-N,N-dimethyl-3-phenylbenzamide.

Molecular Properties

Compound Name4-methoxy-N,N-dimethyl-3-phenylbenzamide
PubChem CID49375903
Molecular FormulaC16H17NO2
Molecular Weight255.32 g/mol
Exact Mass255.13
IUPAC Name4-methoxy-N,N-dimethyl-3-phenylbenzamide
SMILESCOc1ccc(C(=O)N(C)C)cc1-c1ccccc1
InChIInChI=1S/C16H17NO2/c1-17(2)16(18)13-9-10-15(19-3)14(11-13)12-7-5-4-6-8-12/h4-11H,1-3H3
InChIKeyWUVGVNYWHRSEQS-UHFFFAOYSA-N
XLogP3.06
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 53.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

methyl 4-methoxy-3-phenylbenzoate
CID 11010121
N-[(1R)-1-(2,5-difluorophenyl)ethyl]-4-methoxy-N-methyl-3-phenylbenzamide
CID 95068212
3-methoxy-N,N-dimethyl-4-(2-methylphenyl)benzamide
CID 144693423
4-(4-methoxy-3-phenylphenyl)-2-methylidene-4-oxobutanoic acid
CID 70638858
4-methoxy-N-(4-methoxybutyl)-3-phenylbenzamide
CID 49326379
4-methoxy-N-methyl-3-phenyl-N-(4-phenylphenyl)aniline
CID 147076032
5-(dimethylcarbamoyl)-2-phenylbenzenesulfinic acid
CID 118965991
3-(3-hydroxyphenyl)-4-methoxybenzoic acid
CID 115045204
1-(4-methoxy-3-phenylphenyl)-5-phenylpentan-1-one
CID 24989559
3-[3-[(dimethylamino)methyl]phenyl]-4-methoxybenzoic acid
CID 82039455
2-[[4-[(4-methoxy-3-phenylbenzoyl)amino]benzoyl]amino]acetic acid
CID 75429308
3-(3-bromophenyl)-4-methoxybenzoic acid
CID 115503797

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N,N-dimethyl-3-phenylbenzamide?
The IUPAC name of 4-methoxy-N,N-dimethyl-3-phenylbenzamide (CID 49375903) is 4-methoxy-N,N-dimethyl-3-phenylbenzamide.
What is the SMILES notation for 4-methoxy-N,N-dimethyl-3-phenylbenzamide?
The canonical SMILES for 4-methoxy-N,N-dimethyl-3-phenylbenzamide is COc1ccc(C(=O)N(C)C)cc1-c1ccccc1.
What is the InChIKey of 4-methoxy-N,N-dimethyl-3-phenylbenzamide?
The InChIKey is WUVGVNYWHRSEQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO2/c1-17(2)16(18)13-9-10-15(19-3)14(11-13)12-7-5-4-6-8-12/h4-11H,1-3H3.
What are the key properties of 4-methoxy-N,N-dimethyl-3-phenylbenzamide?
4-methoxy-N,N-dimethyl-3-phenylbenzamide has a molecular weight of 255.32 g/mol, XLogP of 3.06, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N,N-dimethyl-3-phenylbenzamide is sourced from PubChem (CID 49375903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).