2-methyl-1-[(1-phenylpyrazol-3-yl)methyl]imidazole

C14H14N4 — CID 62301544

IUPAC2-methyl-1-[(1-phenylpyrazol-3-yl)methyl]imidazole
SMILESCc1nccn1Cc1ccn(-c2ccccc2)n1
InChIInChI=1S/C14H14N4/c1-12-15-8-10-17(12)11-13-7-9-18(16-13)14-5-3-2-4-6-14/h2-10H,11H2,1H3
InChIKeyXVESQBQHFKTXJR-UHFFFAOYSA-N
MW238.29 g/mol
LogP2.43
Rot. Bonds3

About 2-methyl-1-[(1-phenylpyrazol-3-yl)methyl]imidazole

2-methyl-1-[(1-phenylpyrazol-3-yl)methyl]imidazole (PubChem CID 62301544) has the molecular formula C14H14N4 and a molecular weight of 238.29 g/mol. Its IUPAC name is 2-methyl-1-[(1-phenylpyrazol-3-yl)methyl]imidazole.

Molecular Properties

Compound Name2-methyl-1-[(1-phenylpyrazol-3-yl)methyl]imidazole
PubChem CID62301544
Molecular FormulaC14H14N4
Molecular Weight238.29 g/mol
Exact Mass238.12
IUPAC Name2-methyl-1-[(1-phenylpyrazol-3-yl)methyl]imidazole
SMILESCc1nccn1Cc1ccn(-c2ccccc2)n1
InChIInChI=1S/C14H14N4/c1-12-15-8-10-17(12)11-13-7-9-18(16-13)14-5-3-2-4-6-14/h2-10H,11H2,1H3
InChIKeyXVESQBQHFKTXJR-UHFFFAOYSA-N
XLogP2.43
TPSA35.64 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 52.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-methyl-1-[(1-phenylpyrazol-3-yl)methyl]imidazole 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-benzyl-2-methylimidazole
CID 158634472
1-phenyl-3-(pyrrol-1-ylmethyl)pyrazole
CID 63811432
5-iodo-2-methyl-3-[(1-phenylpyrazol-3-yl)methyl]pyrimidin-4-one
CID 66342044
2-(1-phenylpyrazol-3-yl)ethanamine
CID 47003016
N-[[1-[(1-phenylpyrazol-3-yl)methyl]imidazol-4-yl]methyl]ethanamine
CID 106718601
1-[1-[(1-phenylpyrazol-3-yl)methyl]piperidin-4-yl]ethanamine
CID 63595893
2-(1-phenylpyrazol-3-yl)acetaldehyde
CID 86021167
ethane;3-methyl-1-phenylpyrazole
CID 91357840
4-(3-ethylpyrazol-1-yl)pyridine
CID 66015534
[6-[(2-methylimidazol-1-yl)methyl]-2-pyridinyl]hydrazine
CID 79231218
2-methyl-4-[(2-methylimidazol-1-yl)methyl]quinoline
CID 78995513
[1-[(1-phenylpyrazol-3-yl)methyl]pyrrol-3-yl]methanol
CID 66398924

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-[(1-phenylpyrazol-3-yl)methyl]imidazole?
The IUPAC name of 2-methyl-1-[(1-phenylpyrazol-3-yl)methyl]imidazole (CID 62301544) is 2-methyl-1-[(1-phenylpyrazol-3-yl)methyl]imidazole.
What is the SMILES notation for 2-methyl-1-[(1-phenylpyrazol-3-yl)methyl]imidazole?
The canonical SMILES for 2-methyl-1-[(1-phenylpyrazol-3-yl)methyl]imidazole is Cc1nccn1Cc1ccn(-c2ccccc2)n1.
What is the InChIKey of 2-methyl-1-[(1-phenylpyrazol-3-yl)methyl]imidazole?
The InChIKey is XVESQBQHFKTXJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4/c1-12-15-8-10-17(12)11-13-7-9-18(16-13)14-5-3-2-4-6-14/h2-10H,11H2,1H3.
What are the key properties of 2-methyl-1-[(1-phenylpyrazol-3-yl)methyl]imidazole?
2-methyl-1-[(1-phenylpyrazol-3-yl)methyl]imidazole has a molecular weight of 238.29 g/mol, XLogP of 2.43, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-[(1-phenylpyrazol-3-yl)methyl]imidazole is sourced from PubChem (CID 62301544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).