3-[2-(dimethylamino)phenyl]-4-methoxy-N-methylbenzamide

C17H20N2O2 — CID 119069642

IUPAC3-[2-(dimethylamino)phenyl]-4-methoxy-N-methylbenzamide
SMILESCNC(=O)c1ccc(OC)c(-c2ccccc2N(C)C)c1
InChIInChI=1S/C17H20N2O2/c1-18-17(20)12-9-10-16(21-4)14(11-12)13-7-5-6-8-15(13)19(2)3/h5-11H,1-4H3,(H,18,20)
InChIKeyQJDGENMAUMMUJZ-UHFFFAOYSA-N
MW284.36 g/mol
LogP2.79
Rot. Bonds4

About 3-[2-(dimethylamino)phenyl]-4-methoxy-N-methylbenzamide

3-[2-(dimethylamino)phenyl]-4-methoxy-N-methylbenzamide (PubChem CID 119069642) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is 3-[2-(dimethylamino)phenyl]-4-methoxy-N-methylbenzamide.

Molecular Properties

Compound Name3-[2-(dimethylamino)phenyl]-4-methoxy-N-methylbenzamide
PubChem CID119069642
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC Name3-[2-(dimethylamino)phenyl]-4-methoxy-N-methylbenzamide
SMILESCNC(=O)c1ccc(OC)c(-c2ccccc2N(C)C)c1
InChIInChI=1S/C17H20N2O2/c1-18-17(20)12-9-10-16(21-4)14(11-12)13-7-5-6-8-15(13)19(2)3/h5-11H,1-4H3,(H,18,20)
InChIKeyQJDGENMAUMMUJZ-UHFFFAOYSA-N
XLogP2.79
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-methoxy-N-methylbenzamide
CID 39741115
4-methoxy-N-methyl-3-phenylmethoxybenzamide
CID 138553454
[2-methoxy-4-(methylcarbamoyl)phenyl] thiohypoiodite
CID 122522384
1-[3-(2-chlorophenyl)-4-methoxyphenyl]ethanone
CID 82541177
4-methoxy-N,N-dimethyl-3-phenylbenzamide
CID 49375903
6-(dimethylamino)-N-[2-methoxy-5-(methylcarbamoyl)phenyl]pyridine-3-carboxamide
CID 78887354
methyl 4-methoxy-3-phenylbenzoate
CID 11010121
3-(dimethylamino)-4-methoxybenzoic acid;hydrochloride
CID 53429691
N-[2-(dimethylamino)phenyl]-3,4,5-trimethoxybenzamide;hydrochloride
CID 157076630
4-methoxy-3-[(3-methoxybenzoyl)amino]-N-methylbenzamide
CID 87001832
3-[(2,3-dimethoxyphenyl)methyl]-4-methoxy-N-methylbenzamide
CID 70706683
4-amino-3-[methoxy(methyl)amino]-N-methylbenzamide
CID 63357385

Frequently Asked Questions

What is the IUPAC name of 3-[2-(dimethylamino)phenyl]-4-methoxy-N-methylbenzamide?
The IUPAC name of 3-[2-(dimethylamino)phenyl]-4-methoxy-N-methylbenzamide (CID 119069642) is 3-[2-(dimethylamino)phenyl]-4-methoxy-N-methylbenzamide.
What is the SMILES notation for 3-[2-(dimethylamino)phenyl]-4-methoxy-N-methylbenzamide?
The canonical SMILES for 3-[2-(dimethylamino)phenyl]-4-methoxy-N-methylbenzamide is CNC(=O)c1ccc(OC)c(-c2ccccc2N(C)C)c1.
What is the InChIKey of 3-[2-(dimethylamino)phenyl]-4-methoxy-N-methylbenzamide?
The InChIKey is QJDGENMAUMMUJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-18-17(20)12-9-10-16(21-4)14(11-12)13-7-5-6-8-15(13)19(2)3/h5-11H,1-4H3,(H,18,20).
What are the key properties of 3-[2-(dimethylamino)phenyl]-4-methoxy-N-methylbenzamide?
3-[2-(dimethylamino)phenyl]-4-methoxy-N-methylbenzamide has a molecular weight of 284.36 g/mol, XLogP of 2.79, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(dimethylamino)phenyl]-4-methoxy-N-methylbenzamide is sourced from PubChem (CID 119069642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).