3-(dimethylamino)-N-(1H-imidazol-2-ylmethyl)-N-methylbenzamide

C14H18N4O — CID 63928901

IUPAC3-(dimethylamino)-N-(1H-imidazol-2-ylmethyl)-N-methylbenzamide
SMILESCN(Cc1ncc[nH]1)C(=O)c1cccc(N(C)C)c1
InChIInChI=1S/C14H18N4O/c1-17(2)12-6-4-5-11(9-12)14(19)18(3)10-13-15-7-8-16-13/h4-9H,10H2,1-3H3,(H,15,16)
InChIKeyPIYCVJRKJKDBQU-UHFFFAOYSA-N
MW258.32 g/mol
LogP1.75
Rot. Bonds4

About 3-(dimethylamino)-N-(1H-imidazol-2-ylmethyl)-N-methylbenzamide

3-(dimethylamino)-N-(1H-imidazol-2-ylmethyl)-N-methylbenzamide (PubChem CID 63928901) has the molecular formula C14H18N4O and a molecular weight of 258.32 g/mol. Its IUPAC name is 3-(dimethylamino)-N-(1H-imidazol-2-ylmethyl)-N-methylbenzamide.

Molecular Properties

Compound Name3-(dimethylamino)-N-(1H-imidazol-2-ylmethyl)-N-methylbenzamide
PubChem CID63928901
Molecular FormulaC14H18N4O
Molecular Weight258.32 g/mol
Exact Mass258.15
IUPAC Name3-(dimethylamino)-N-(1H-imidazol-2-ylmethyl)-N-methylbenzamide
SMILESCN(Cc1ncc[nH]1)C(=O)c1cccc(N(C)C)c1
InChIInChI=1S/C14H18N4O/c1-17(2)12-6-4-5-11(9-12)14(19)18(3)10-13-15-7-8-16-13/h4-9H,10H2,1-3H3,(H,15,16)
InChIKeyPIYCVJRKJKDBQU-UHFFFAOYSA-N
XLogP1.75
TPSA52.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-(dimethylamino)-N-(1H-imidazol-2-ylmethyl)-N-methylbenzamide 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

3-[1H-imidazol-2-ylmethyl(methyl)carbamoyl]benzoic acid
CID 64516965
2-fluoro-N-(1H-imidazol-2-ylmethyl)-N-methylpyridine-4-carboxamide
CID 63929110
4-[1H-imidazol-2-ylmethyl(methyl)carbamoyl]benzoic acid
CID 64519669
3-chloro-N-(1H-imidazol-2-ylmethyl)-4-iodo-N-methylbenzamide
CID 103736159
N-(1H-imidazol-2-ylmethyl)-N-methyl-2,3-dihydro-1H-isoindole-5-carboxamide
CID 103999017
2-hydrazinyl-N-(1H-imidazol-2-ylmethyl)-N-methylpyridine-4-carboxamide
CID 64519698
N-(1H-imidazol-2-ylmethyl)-N-methyl-2-phenylpyrimidine-5-carboxamide
CID 50954561
N-(1H-imidazol-2-ylmethyl)-N-methyl-4-propylbenzamide
CID 56740870
N-(1H-imidazol-2-ylmethyl)-N-methylnaphthalene-1-carboxamide
CID 63928694
N-(1H-imidazol-2-ylmethyl)-N,2,3-trimethylbenzamide
CID 63930376
6-amino-N-(1H-imidazol-2-ylmethyl)-N-methylpyridine-3-carboxamide
CID 64519117
N-(1H-imidazol-2-ylmethyl)-3,5-dimethoxy-N,4-dimethylbenzamide
CID 63929739

Frequently Asked Questions

What is the IUPAC name of 3-(dimethylamino)-N-(1H-imidazol-2-ylmethyl)-N-methylbenzamide?
The IUPAC name of 3-(dimethylamino)-N-(1H-imidazol-2-ylmethyl)-N-methylbenzamide (CID 63928901) is 3-(dimethylamino)-N-(1H-imidazol-2-ylmethyl)-N-methylbenzamide.
What is the SMILES notation for 3-(dimethylamino)-N-(1H-imidazol-2-ylmethyl)-N-methylbenzamide?
The canonical SMILES for 3-(dimethylamino)-N-(1H-imidazol-2-ylmethyl)-N-methylbenzamide is CN(Cc1ncc[nH]1)C(=O)c1cccc(N(C)C)c1.
What is the InChIKey of 3-(dimethylamino)-N-(1H-imidazol-2-ylmethyl)-N-methylbenzamide?
The InChIKey is PIYCVJRKJKDBQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O/c1-17(2)12-6-4-5-11(9-12)14(19)18(3)10-13-15-7-8-16-13/h4-9H,10H2,1-3H3,(H,15,16).
What are the key properties of 3-(dimethylamino)-N-(1H-imidazol-2-ylmethyl)-N-methylbenzamide?
3-(dimethylamino)-N-(1H-imidazol-2-ylmethyl)-N-methylbenzamide has a molecular weight of 258.32 g/mol, XLogP of 1.75, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylamino)-N-(1H-imidazol-2-ylmethyl)-N-methylbenzamide is sourced from PubChem (CID 63928901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).