N-benzyl-1-methyl-5-phenylimidazol-2-amine

C17H17N3 — CID 1096462

IUPACN-benzyl-1-methyl-5-phenylimidazol-2-amine
SMILESCn1c(-c2ccccc2)cnc1NCc1ccccc1
InChIInChI=1S/C17H17N3/c1-20-16(15-10-6-3-7-11-15)13-19-17(20)18-12-14-8-4-2-5-9-14/h2-11,13H,12H2,1H3,(H,18,19)
InChIKeyVUCSBDVPNNHFCV-UHFFFAOYSA-N
MW263.34 g/mol
LogP3.70
Rot. Bonds4

About N-benzyl-1-methyl-5-phenylimidazol-2-amine

N-benzyl-1-methyl-5-phenylimidazol-2-amine (PubChem CID 1096462) has the molecular formula C17H17N3 and a molecular weight of 263.34 g/mol. Its IUPAC name is N-benzyl-1-methyl-5-phenylimidazol-2-amine.

Molecular Properties

Compound NameN-benzyl-1-methyl-5-phenylimidazol-2-amine
PubChem CID1096462
Molecular FormulaC17H17N3
Molecular Weight263.34 g/mol
Exact Mass263.14
IUPAC NameN-benzyl-1-methyl-5-phenylimidazol-2-amine
SMILESCn1c(-c2ccccc2)cnc1NCc1ccccc1
InChIInChI=1S/C17H17N3/c1-20-16(15-10-6-3-7-11-15)13-19-17(20)18-12-14-8-4-2-5-9-14/h2-11,13H,12H2,1H3,(H,18,19)
InChIKeyVUCSBDVPNNHFCV-UHFFFAOYSA-N
XLogP3.70
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-benzyl-1-methyl-5-phenylimidazol-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-benzyl-1-methyl-5-phenylimidazol-2-amine?
The IUPAC name of N-benzyl-1-methyl-5-phenylimidazol-2-amine (CID 1096462) is N-benzyl-1-methyl-5-phenylimidazol-2-amine.
What is the SMILES notation for N-benzyl-1-methyl-5-phenylimidazol-2-amine?
The canonical SMILES for N-benzyl-1-methyl-5-phenylimidazol-2-amine is Cn1c(-c2ccccc2)cnc1NCc1ccccc1.
What is the InChIKey of N-benzyl-1-methyl-5-phenylimidazol-2-amine?
The InChIKey is VUCSBDVPNNHFCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3/c1-20-16(15-10-6-3-7-11-15)13-19-17(20)18-12-14-8-4-2-5-9-14/h2-11,13H,12H2,1H3,(H,18,19).
What are the key properties of N-benzyl-1-methyl-5-phenylimidazol-2-amine?
N-benzyl-1-methyl-5-phenylimidazol-2-amine has a molecular weight of 263.34 g/mol, XLogP of 3.70, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-1-methyl-5-phenylimidazol-2-amine is sourced from PubChem (CID 1096462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).