N-cyclopropyl-4-[[1H-imidazol-5-ylmethyl(methyl)amino]methyl]benzamide

C16H20N4O — CID 166193454

IUPACN-cyclopropyl-4-[[1H-imidazol-5-ylmethyl(methyl)amino]methyl]benzamide
SMILESCN(Cc1ccc(C(=O)NC2CC2)cc1)Cc1cnc[nH]1
InChIInChI=1S/C16H20N4O/c1-20(10-15-8-17-11-18-15)9-12-2-4-13(5-3-12)16(21)19-14-6-7-14/h2-5,8,11,14H,6-7,9-10H2,1H3,(H,17,18)(H,19,21)
InChIKeySENUXJDAIGYXLL-UHFFFAOYSA-N
MW284.36 g/mol
LogP1.93
Rot. Bonds6

About N-cyclopropyl-4-[[1H-imidazol-5-ylmethyl(methyl)amino]methyl]benzamide

N-cyclopropyl-4-[[1H-imidazol-5-ylmethyl(methyl)amino]methyl]benzamide (PubChem CID 166193454) has the molecular formula C16H20N4O and a molecular weight of 284.36 g/mol. Its IUPAC name is N-cyclopropyl-4-[[1H-imidazol-5-ylmethyl(methyl)amino]methyl]benzamide.

Molecular Properties

Compound NameN-cyclopropyl-4-[[1H-imidazol-5-ylmethyl(methyl)amino]methyl]benzamide
PubChem CID166193454
Molecular FormulaC16H20N4O
Molecular Weight284.36 g/mol
Exact Mass284.16
IUPAC NameN-cyclopropyl-4-[[1H-imidazol-5-ylmethyl(methyl)amino]methyl]benzamide
SMILESCN(Cc1ccc(C(=O)NC2CC2)cc1)Cc1cnc[nH]1
InChIInChI=1S/C16H20N4O/c1-20(10-15-8-17-11-18-15)9-12-2-4-13(5-3-12)16(21)19-14-6-7-14/h2-5,8,11,14H,6-7,9-10H2,1H3,(H,17,18)(H,19,21)
InChIKeySENUXJDAIGYXLL-UHFFFAOYSA-N
XLogP1.93
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-cyclopropyl-4-[[1H-imidazol-5-ylmethyl(methyl)amino]methyl]benzamide 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

4-[(dimethylamino)methyl]-N-(4-hydroxycyclohexyl)benzamide
CID 43393996
N-cyclopropyl-4-[[cyclopropyl-[2-[(4-fluorophenyl)methyl-methylamino]-2-oxoethyl]amino]methyl]benzamide
CID 78847973
N-cyclopropyl-4-[[cyclopropyl(propanoyl)amino]methyl]benzamide
CID 33341018
N-cyclopropyl-4-[[methyl-[2-oxo-2-(2,4,5-trichloroanilino)ethyl]amino]methyl]benzamide
CID 34622925
4-[[benzenesulfonyl(methyl)amino]methyl]-N-cyclopropylbenzamide
CID 95933789
N-cyclopropyl-4-[[cyclopropyl-[2-(4-fluorophenyl)acetyl]amino]methyl]benzamide
CID 34178957
4-(chloromethyl)-N-(4-methylcyclohexyl)benzamide
CID 43333286
N-cyclopropyl-4-[[cyclopropyl-[[2-[cyclopropyl(methyl)amino]-1,3-thiazol-4-yl]methyl]amino]methyl]benzamide
CID 71852307
N-cyclopropyl-4-[[[(2R)-2-hydroxy-2-phenylacetyl]-methylamino]methyl]benzamide
CID 86781611
N-cyclopentyl-2-(1H-imidazol-5-yl)acetamide
CID 110684053
N-cyclopropyl-4-[[methyl-[2-(4-pyrazol-1-ylphenyl)acetyl]amino]methyl]benzamide
CID 46485261
N-[[4-(cyclopropylcarbamoyl)phenyl]methyl]-2,3-diethyl-N-methylquinoxaline-6-carboxamide
CID 30797400

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-4-[[1H-imidazol-5-ylmethyl(methyl)amino]methyl]benzamide?
The IUPAC name of N-cyclopropyl-4-[[1H-imidazol-5-ylmethyl(methyl)amino]methyl]benzamide (CID 166193454) is N-cyclopropyl-4-[[1H-imidazol-5-ylmethyl(methyl)amino]methyl]benzamide.
What is the SMILES notation for N-cyclopropyl-4-[[1H-imidazol-5-ylmethyl(methyl)amino]methyl]benzamide?
The canonical SMILES for N-cyclopropyl-4-[[1H-imidazol-5-ylmethyl(methyl)amino]methyl]benzamide is CN(Cc1ccc(C(=O)NC2CC2)cc1)Cc1cnc[nH]1.
What is the InChIKey of N-cyclopropyl-4-[[1H-imidazol-5-ylmethyl(methyl)amino]methyl]benzamide?
The InChIKey is SENUXJDAIGYXLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O/c1-20(10-15-8-17-11-18-15)9-12-2-4-13(5-3-12)16(21)19-14-6-7-14/h2-5,8,11,14H,6-7,9-10H2,1H3,(H,17,18)(H,19,21).
What are the key properties of N-cyclopropyl-4-[[1H-imidazol-5-ylmethyl(methyl)amino]methyl]benzamide?
N-cyclopropyl-4-[[1H-imidazol-5-ylmethyl(methyl)amino]methyl]benzamide has a molecular weight of 284.36 g/mol, XLogP of 1.93, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-4-[[1H-imidazol-5-ylmethyl(methyl)amino]methyl]benzamide is sourced from PubChem (CID 166193454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).