2-[4-(aminomethyl)imidazol-1-yl]-N-[(2-methoxyphenyl)methyl]benzamide

C19H20N4O2 — CID 110121889

IUPAC2-[4-(aminomethyl)imidazol-1-yl]-N-[(2-methoxyphenyl)methyl]benzamide
SMILESCOc1ccccc1CNC(=O)c1ccccc1-n1cnc(CN)c1
InChIInChI=1S/C19H20N4O2/c1-25-18-9-5-2-6-14(18)11-21-19(24)16-7-3-4-8-17(16)23-12-15(10-20)22-13-23/h2-9,12-13H,10-11,20H2,1H3,(H,21,24)
InChIKeyACXFDIHQRDQHFP-UHFFFAOYSA-N
MW336.40 g/mol
LogP2.27
Rot. Bonds6

About 2-[4-(aminomethyl)imidazol-1-yl]-N-[(2-methoxyphenyl)methyl]benzamide

2-[4-(aminomethyl)imidazol-1-yl]-N-[(2-methoxyphenyl)methyl]benzamide (PubChem CID 110121889) has the molecular formula C19H20N4O2 and a molecular weight of 336.40 g/mol. Its IUPAC name is 2-[4-(aminomethyl)imidazol-1-yl]-N-[(2-methoxyphenyl)methyl]benzamide.

Molecular Properties

Compound Name2-[4-(aminomethyl)imidazol-1-yl]-N-[(2-methoxyphenyl)methyl]benzamide
PubChem CID110121889
Molecular FormulaC19H20N4O2
Molecular Weight336.40 g/mol
Exact Mass336.16
IUPAC Name2-[4-(aminomethyl)imidazol-1-yl]-N-[(2-methoxyphenyl)methyl]benzamide
SMILESCOc1ccccc1CNC(=O)c1ccccc1-n1cnc(CN)c1
InChIInChI=1S/C19H20N4O2/c1-25-18-9-5-2-6-14(18)11-21-19(24)16-7-3-4-8-17(16)23-12-15(10-20)22-13-23/h2-9,12-13H,10-11,20H2,1H3,(H,21,24)
InChIKeyACXFDIHQRDQHFP-UHFFFAOYSA-N
XLogP2.27
TPSA82.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.40
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-[4-(aminomethyl)imidazol-1-yl]-N-[(2-methoxyphenyl)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

2-[4-(aminomethyl)imidazol-1-yl]-N-(pyridin-2-ylmethyl)benzamide
CID 110121856
2-[4-(aminomethyl)imidazol-1-yl]-N-(cyclopropylmethyl)benzamide
CID 110121898
2-[4-(aminomethyl)imidazol-1-yl]-N-[(1R)-1-phenylethyl]benzamide
CID 110121933
[1-(2-ethylphenyl)imidazol-4-yl]methanamine
CID 82506290
2,3-dimethoxy-N-[(2-methoxyphenyl)methyl]benzamide
CID 912335
2-iodo-N-[(2-methoxyphenyl)methyl]benzamide
CID 1378811
[2-[(2-methoxyphenyl)methylcarbamoyl]phenyl] acetate
CID 3362065
2-amino-5-bromo-N-[(2-methoxyphenyl)methyl]pyridine-3-carboxamide
CID 62152678
2,4,5-trimethoxy-N-[(2-methoxyphenyl)methyl]benzamide
CID 912738
2-[1-(2-methoxyphenyl)imidazol-4-yl]ethanamine
CID 82471834
N-[(2-methoxyphenyl)methyl]quinoxaline-5-carboxamide
CID 110701357
3-hydroxy-N-[(2-methoxyphenyl)methyl]-2-methylbenzamide
CID 82786350

Frequently Asked Questions

What is the IUPAC name of 2-[4-(aminomethyl)imidazol-1-yl]-N-[(2-methoxyphenyl)methyl]benzamide?
The IUPAC name of 2-[4-(aminomethyl)imidazol-1-yl]-N-[(2-methoxyphenyl)methyl]benzamide (CID 110121889) is 2-[4-(aminomethyl)imidazol-1-yl]-N-[(2-methoxyphenyl)methyl]benzamide.
What is the SMILES notation for 2-[4-(aminomethyl)imidazol-1-yl]-N-[(2-methoxyphenyl)methyl]benzamide?
The canonical SMILES for 2-[4-(aminomethyl)imidazol-1-yl]-N-[(2-methoxyphenyl)methyl]benzamide is COc1ccccc1CNC(=O)c1ccccc1-n1cnc(CN)c1.
What is the InChIKey of 2-[4-(aminomethyl)imidazol-1-yl]-N-[(2-methoxyphenyl)methyl]benzamide?
The InChIKey is ACXFDIHQRDQHFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O2/c1-25-18-9-5-2-6-14(18)11-21-19(24)16-7-3-4-8-17(16)23-12-15(10-20)22-13-23/h2-9,12-13H,10-11,20H2,1H3,(H,21,24).
What are the key properties of 2-[4-(aminomethyl)imidazol-1-yl]-N-[(2-methoxyphenyl)methyl]benzamide?
2-[4-(aminomethyl)imidazol-1-yl]-N-[(2-methoxyphenyl)methyl]benzamide has a molecular weight of 336.40 g/mol, XLogP of 2.27, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(aminomethyl)imidazol-1-yl]-N-[(2-methoxyphenyl)methyl]benzamide is sourced from PubChem (CID 110121889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).