2-methyl-1-[(3-methyl-2-pyridinyl)methyl]benzimidazole

C15H15N3 — CID 112651453

IUPAC2-methyl-1-[(3-methyl-2-pyridinyl)methyl]benzimidazole
SMILESCc1cccnc1Cn1c(C)nc2ccccc21
InChIInChI=1S/C15H15N3/c1-11-6-5-9-16-14(11)10-18-12(2)17-13-7-3-4-8-15(13)18/h3-9H,10H2,1-2H3
InChIKeyDFGQEMNMSJDZQV-UHFFFAOYSA-N
MW237.31 g/mol
LogP3.10
Rot. Bonds2

About 2-methyl-1-[(3-methyl-2-pyridinyl)methyl]benzimidazole

2-methyl-1-[(3-methyl-2-pyridinyl)methyl]benzimidazole (PubChem CID 112651453) has the molecular formula C15H15N3 and a molecular weight of 237.31 g/mol. Its IUPAC name is 2-methyl-1-[(3-methyl-2-pyridinyl)methyl]benzimidazole.

Molecular Properties

Compound Name2-methyl-1-[(3-methyl-2-pyridinyl)methyl]benzimidazole
PubChem CID112651453
Molecular FormulaC15H15N3
Molecular Weight237.31 g/mol
Exact Mass237.13
IUPAC Name2-methyl-1-[(3-methyl-2-pyridinyl)methyl]benzimidazole
SMILESCc1cccnc1Cn1c(C)nc2ccccc21
InChIInChI=1S/C15H15N3/c1-11-6-5-9-16-14(11)10-18-12(2)17-13-7-3-4-8-15(13)18/h3-9H,10H2,1-2H3
InChIKeyDFGQEMNMSJDZQV-UHFFFAOYSA-N
XLogP3.10
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.31
LogP ≤ 53.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-[1-[(3-methyl-2-pyridinyl)methyl]benzimidazol-2-yl]ethanethioamide
CID 115982441
1-[(2-chloro-3-pyridinyl)methyl]-2-methylbenzimidazole
CID 62470224
2-methyl-1-[[2-[(2-methylbenzimidazol-1-yl)methyl]phenyl]methyl]benzimidazole
CID 154733183
1-[(1-ethylimidazol-2-yl)methyl]-2-methylbenzimidazole
CID 79760580
2-methyl-5-[(2-methylbenzimidazol-1-yl)methyl]-1,3-thiazole
CID 78971489
1-[(2-chlorophenyl)methyl]-2-methylbenzimidazole
CID 709571
6-bromo-2-(chloromethyl)-1-[(3-methyl-2-pyridinyl)methyl]benzimidazole
CID 65346157
1-(2,2-dimethylpropyl)-2-methylbenzimidazole
CID 21060284
2-(2-methylbenzimidazol-1-yl)ethanol
CID 761926
2-(2-methylbenzimidazol-1-yl)ethane-1,1-diol
CID 134100901
6-chloro-2-(1-chloroethyl)-1-[(3-methyl-2-pyridinyl)methyl]benzimidazole
CID 115471524
2-(chloromethyl)-1-[(3-ethyl-2-pyridinyl)methyl]benzimidazole
CID 82742020

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-[(3-methyl-2-pyridinyl)methyl]benzimidazole?
The IUPAC name of 2-methyl-1-[(3-methyl-2-pyridinyl)methyl]benzimidazole (CID 112651453) is 2-methyl-1-[(3-methyl-2-pyridinyl)methyl]benzimidazole.
What is the SMILES notation for 2-methyl-1-[(3-methyl-2-pyridinyl)methyl]benzimidazole?
The canonical SMILES for 2-methyl-1-[(3-methyl-2-pyridinyl)methyl]benzimidazole is Cc1cccnc1Cn1c(C)nc2ccccc21.
What is the InChIKey of 2-methyl-1-[(3-methyl-2-pyridinyl)methyl]benzimidazole?
The InChIKey is DFGQEMNMSJDZQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3/c1-11-6-5-9-16-14(11)10-18-12(2)17-13-7-3-4-8-15(13)18/h3-9H,10H2,1-2H3.
What are the key properties of 2-methyl-1-[(3-methyl-2-pyridinyl)methyl]benzimidazole?
2-methyl-1-[(3-methyl-2-pyridinyl)methyl]benzimidazole has a molecular weight of 237.31 g/mol, XLogP of 3.10, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-[(3-methyl-2-pyridinyl)methyl]benzimidazole is sourced from PubChem (CID 112651453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).