N-[(5-methyl-1H-imidazol-2-yl)methyl]-1-phenylmethanamine

C12H15N3 — CID 46784169

IUPACN-[(5-methyl-1H-imidazol-2-yl)methyl]-1-phenylmethanamine
SMILESCc1cnc(CNCc2ccccc2)[nH]1
InChIInChI=1S/C12H15N3/c1-10-7-14-12(15-10)9-13-8-11-5-3-2-4-6-11/h2-7,13H,8-9H2,1H3,(H,14,15)
InChIKeyNQZHERQAEXDQSA-UHFFFAOYSA-N
MW201.27 g/mol
LogP2.01
Rot. Bonds4

About N-[(5-methyl-1H-imidazol-2-yl)methyl]-1-phenylmethanamine

N-[(5-methyl-1H-imidazol-2-yl)methyl]-1-phenylmethanamine (PubChem CID 46784169) has the molecular formula C12H15N3 and a molecular weight of 201.27 g/mol. Its IUPAC name is N-[(5-methyl-1H-imidazol-2-yl)methyl]-1-phenylmethanamine.

Molecular Properties

Compound NameN-[(5-methyl-1H-imidazol-2-yl)methyl]-1-phenylmethanamine
PubChem CID46784169
Molecular FormulaC12H15N3
Molecular Weight201.27 g/mol
Exact Mass201.13
IUPAC NameN-[(5-methyl-1H-imidazol-2-yl)methyl]-1-phenylmethanamine
SMILESCc1cnc(CNCc2ccccc2)[nH]1
InChIInChI=1S/C12H15N3/c1-10-7-14-12(15-10)9-13-8-11-5-3-2-4-6-11/h2-7,13H,8-9H2,1H3,(H,14,15)
InChIKeyNQZHERQAEXDQSA-UHFFFAOYSA-N
XLogP2.01
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 52.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-[(5-methyl-1H-imidazol-2-yl)methyl]-1-phenylmethanamine 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

1-(3-fluorophenyl)-N-[(5-methyl-1H-imidazol-2-yl)methyl]methanamine
CID 46784765
N-methyl-1-(5-methyl-1H-imidazol-2-yl)methanamine;dihydrochloride
CID 53398821
N-benzyl-1-phenylmethanamine;hydrate
CID 173452781
N-[(2-benzyl-1H-imidazol-5-yl)methyl]ethanamine
CID 63108604
N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-phenylmethanamine
CID 103738795
N-benzyl-1-phenylmethanamine;λ2-stannane;hydrochloride
CID 174862297
N-[(4,6-dimethyl-3-pyridinyl)methyl]-1-phenylmethanamine
CID 130854459
(2S)-2-methoxy-N-[(5-methyl-1H-imidazol-2-yl)methyl]-2-phenylacetamide
CID 99949568
N-[(5-fluoro-3-methyl-2-pyridinyl)methyl]-1-phenylmethanamine
CID 169111460
N-[(3-methyltriazol-4-yl)methyl]-1-phenylmethanamine
CID 115682087
N-[[4-(6-methyl-2-pyridinyl)-5-pyridin-2-yl-1H-imidazol-2-yl]methyl]-1-phenylmethanamine
CID 155582297
1-phenyl-N-[(2-phenylpyrimidin-5-yl)methyl]methanamine;hydrochloride
CID 132893916

Frequently Asked Questions

What is the IUPAC name of N-[(5-methyl-1H-imidazol-2-yl)methyl]-1-phenylmethanamine?
The IUPAC name of N-[(5-methyl-1H-imidazol-2-yl)methyl]-1-phenylmethanamine (CID 46784169) is N-[(5-methyl-1H-imidazol-2-yl)methyl]-1-phenylmethanamine.
What is the SMILES notation for N-[(5-methyl-1H-imidazol-2-yl)methyl]-1-phenylmethanamine?
The canonical SMILES for N-[(5-methyl-1H-imidazol-2-yl)methyl]-1-phenylmethanamine is Cc1cnc(CNCc2ccccc2)[nH]1.
What is the InChIKey of N-[(5-methyl-1H-imidazol-2-yl)methyl]-1-phenylmethanamine?
The InChIKey is NQZHERQAEXDQSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3/c1-10-7-14-12(15-10)9-13-8-11-5-3-2-4-6-11/h2-7,13H,8-9H2,1H3,(H,14,15).
What are the key properties of N-[(5-methyl-1H-imidazol-2-yl)methyl]-1-phenylmethanamine?
N-[(5-methyl-1H-imidazol-2-yl)methyl]-1-phenylmethanamine has a molecular weight of 201.27 g/mol, XLogP of 2.01, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-methyl-1H-imidazol-2-yl)methyl]-1-phenylmethanamine is sourced from PubChem (CID 46784169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).