3-[benzyl(methyl)amino]-N-[2-(dimethylamino)ethyl]benzamide

C19H25N3O — CID 110355481

IUPAC3-[benzyl(methyl)amino]-N-[2-(dimethylamino)ethyl]benzamide
SMILESCN(C)CCNC(=O)c1cccc(N(C)Cc2ccccc2)c1
InChIInChI=1S/C19H25N3O/c1-21(2)13-12-20-19(23)17-10-7-11-18(14-17)22(3)15-16-8-5-4-6-9-16/h4-11,14H,12-13,15H2,1-3H3,(H,20,23)
InChIKeyYEWYXHVQURYOBF-UHFFFAOYSA-N
MW311.43 g/mol
LogP2.61
Rot. Bonds7

About 3-[benzyl(methyl)amino]-N-[2-(dimethylamino)ethyl]benzamide

3-[benzyl(methyl)amino]-N-[2-(dimethylamino)ethyl]benzamide (PubChem CID 110355481) has the molecular formula C19H25N3O and a molecular weight of 311.43 g/mol. Its IUPAC name is 3-[benzyl(methyl)amino]-N-[2-(dimethylamino)ethyl]benzamide.

Molecular Properties

Compound Name3-[benzyl(methyl)amino]-N-[2-(dimethylamino)ethyl]benzamide
PubChem CID110355481
Molecular FormulaC19H25N3O
Molecular Weight311.43 g/mol
Exact Mass311.20
IUPAC Name3-[benzyl(methyl)amino]-N-[2-(dimethylamino)ethyl]benzamide
SMILESCN(C)CCNC(=O)c1cccc(N(C)Cc2ccccc2)c1
InChIInChI=1S/C19H25N3O/c1-21(2)13-12-20-19(23)17-10-7-11-18(14-17)22(3)15-16-8-5-4-6-9-16/h4-11,14H,12-13,15H2,1-3H3,(H,20,23)
InChIKeyYEWYXHVQURYOBF-UHFFFAOYSA-N
XLogP2.61
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.43
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-anilino-2-oxoethyl)-3-[benzyl(methyl)amino]benzamide
CID 110353754
3-(chloromethyl)-N-[2-(N-methylanilino)ethyl]benzamide
CID 43347009
3-[benzyl(methyl)amino]-N-(1,1-dioxothiolan-3-yl)benzamide
CID 110355698
3-[[(N-benzyl-N,N'-dimethylcarbamimidoyl)amino]methyl]-N-[2-(dimethylamino)ethyl]benzamide;hydroiodide
CID 110950795
3-(dimethylamino)-N-(3-phenylpropyl)benzamide
CID 25335787
N-[2-(dimethylamino)ethyl]-3-(3-ethylphenyl)benzamide
CID 70827081
2-[[3-[benzyl(methyl)amino]benzoyl]amino]-N-methylbenzamide
CID 110606707
5-N-[2-(dimethylamino)ethyl]-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide
CID 109104046
3-N-[2-(dimethylamino)ethyl]-1-N-[2-(2-fluorophenyl)ethyl]benzene-1,3-dicarboxamide
CID 109053145
N-benzyl-N-[3-[2-[2-(dimethylamino)ethylamino]-2-oxoethyl]phenyl]-3-fluorobenzamide
CID 42859313
N-[2-(dimethylamino)ethyl]-3-(indol-1-ylmethyl)benzamide
CID 23513989
1-N,4-N-bis[2-(N-methylanilino)ethyl]benzene-1,4-dicarboxamide
CID 35617422

Frequently Asked Questions

What is the IUPAC name of 3-[benzyl(methyl)amino]-N-[2-(dimethylamino)ethyl]benzamide?
The IUPAC name of 3-[benzyl(methyl)amino]-N-[2-(dimethylamino)ethyl]benzamide (CID 110355481) is 3-[benzyl(methyl)amino]-N-[2-(dimethylamino)ethyl]benzamide.
What is the SMILES notation for 3-[benzyl(methyl)amino]-N-[2-(dimethylamino)ethyl]benzamide?
The canonical SMILES for 3-[benzyl(methyl)amino]-N-[2-(dimethylamino)ethyl]benzamide is CN(C)CCNC(=O)c1cccc(N(C)Cc2ccccc2)c1.
What is the InChIKey of 3-[benzyl(methyl)amino]-N-[2-(dimethylamino)ethyl]benzamide?
The InChIKey is YEWYXHVQURYOBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O/c1-21(2)13-12-20-19(23)17-10-7-11-18(14-17)22(3)15-16-8-5-4-6-9-16/h4-11,14H,12-13,15H2,1-3H3,(H,20,23).
What are the key properties of 3-[benzyl(methyl)amino]-N-[2-(dimethylamino)ethyl]benzamide?
3-[benzyl(methyl)amino]-N-[2-(dimethylamino)ethyl]benzamide has a molecular weight of 311.43 g/mol, XLogP of 2.61, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[benzyl(methyl)amino]-N-[2-(dimethylamino)ethyl]benzamide is sourced from PubChem (CID 110355481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).