2-N,2-N-dimethyl-4-phenylmethoxybenzene-1,2-dicarboxamide

C17H18N2O3 — CID 69299072

IUPAC2-N,2-N-dimethyl-4-phenylmethoxybenzene-1,2-dicarboxamide
SMILESCN(C)C(=O)c1cc(OCc2ccccc2)ccc1C(N)=O
InChIInChI=1S/C17H18N2O3/c1-19(2)17(21)15-10-13(8-9-14(15)16(18)20)22-11-12-6-4-3-5-7-12/h3-10H,11H2,1-2H3,(H2,18,20)
InChIKeyWSSOUMUEQWCRNH-UHFFFAOYSA-N
MW298.34 g/mol
LogP2.07
Rot. Bonds5

About 2-N,2-N-dimethyl-4-phenylmethoxybenzene-1,2-dicarboxamide

2-N,2-N-dimethyl-4-phenylmethoxybenzene-1,2-dicarboxamide (PubChem CID 69299072) has the molecular formula C17H18N2O3 and a molecular weight of 298.34 g/mol. Its IUPAC name is 2-N,2-N-dimethyl-4-phenylmethoxybenzene-1,2-dicarboxamide.

Molecular Properties

Compound Name2-N,2-N-dimethyl-4-phenylmethoxybenzene-1,2-dicarboxamide
PubChem CID69299072
Molecular FormulaC17H18N2O3
Molecular Weight298.34 g/mol
Exact Mass298.13
IUPAC Name2-N,2-N-dimethyl-4-phenylmethoxybenzene-1,2-dicarboxamide
SMILESCN(C)C(=O)c1cc(OCc2ccccc2)ccc1C(N)=O
InChIInChI=1S/C17H18N2O3/c1-19(2)17(21)15-10-13(8-9-14(15)16(18)20)22-11-12-6-4-3-5-7-12/h3-10H,11H2,1-2H3,(H2,18,20)
InChIKeyWSSOUMUEQWCRNH-UHFFFAOYSA-N
XLogP2.07
TPSA72.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.34
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-N,2-N-dimethyl-4-phenylmethoxybenzene-1,2-dicarboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

ethane;4-phenylmethoxyphthalic acid
CID 90802135
N,N-dimethyl-3-phenylmethoxybenzamide
CID 8778645
2-[(3-phenylmethoxyphenyl)methoxy]benzamide
CID 60603891
2-bromo-N,N-diethyl-5-phenylmethoxybenzamide
CID 156880220
1-(2-bromo-4-phenylmethoxyphenyl)ethanone
CID 70433955
2-[(2R)-3-amino-2-hydroxypropoxy]-4-[(4-methoxyphenyl)methoxy]-N,N-dimethylbenzamide
CID 69199785
5-(dimethylamino)-2-phenylmethoxybenzamide
CID 141273591
2-(2-methylpropoxy)-4-phenylmethoxybenzoic acid
CID 10709345
3-(dimethylamino)-1-(2-hydroxy-4-phenylmethoxyphenyl)prop-2-en-1-one
CID 75210946
2-bromo-5-phenylmethoxybenzoic acid
CID 15891190
3-[[4-[[3-(dimethylcarbamoyl)phenoxy]methyl]phenyl]methoxy]-N,N-dimethylbenzamide
CID 167758770
2-carboxy-5-phenylmethoxyphenolate
CID 86309199

Frequently Asked Questions

What is the IUPAC name of 2-N,2-N-dimethyl-4-phenylmethoxybenzene-1,2-dicarboxamide?
The IUPAC name of 2-N,2-N-dimethyl-4-phenylmethoxybenzene-1,2-dicarboxamide (CID 69299072) is 2-N,2-N-dimethyl-4-phenylmethoxybenzene-1,2-dicarboxamide.
What is the SMILES notation for 2-N,2-N-dimethyl-4-phenylmethoxybenzene-1,2-dicarboxamide?
The canonical SMILES for 2-N,2-N-dimethyl-4-phenylmethoxybenzene-1,2-dicarboxamide is CN(C)C(=O)c1cc(OCc2ccccc2)ccc1C(N)=O.
What is the InChIKey of 2-N,2-N-dimethyl-4-phenylmethoxybenzene-1,2-dicarboxamide?
The InChIKey is WSSOUMUEQWCRNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O3/c1-19(2)17(21)15-10-13(8-9-14(15)16(18)20)22-11-12-6-4-3-5-7-12/h3-10H,11H2,1-2H3,(H2,18,20).
What are the key properties of 2-N,2-N-dimethyl-4-phenylmethoxybenzene-1,2-dicarboxamide?
2-N,2-N-dimethyl-4-phenylmethoxybenzene-1,2-dicarboxamide has a molecular weight of 298.34 g/mol, XLogP of 2.07, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-N-dimethyl-4-phenylmethoxybenzene-1,2-dicarboxamide is sourced from PubChem (CID 69299072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).