1-benzyl-2-methylimidazo[4,5-b]pyridine

C14H13N3 — CID 151866013

IUPAC1-benzyl-2-methylimidazo[4,5-b]pyridine
SMILESCc1nc2ncccc2n1Cc1ccccc1
InChIInChI=1S/C14H13N3/c1-11-16-14-13(8-5-9-15-14)17(11)10-12-6-3-2-4-7-12/h2-9H,10H2,1H3
InChIKeySLRRLMUCYBULNG-UHFFFAOYSA-N
MW223.28 g/mol
LogP2.79
Rot. Bonds2

About 1-benzyl-2-methylimidazo[4,5-b]pyridine

1-benzyl-2-methylimidazo[4,5-b]pyridine (PubChem CID 151866013) has the molecular formula C14H13N3 and a molecular weight of 223.28 g/mol. Its IUPAC name is 1-benzyl-2-methylimidazo[4,5-b]pyridine.

Molecular Properties

Compound Name1-benzyl-2-methylimidazo[4,5-b]pyridine
PubChem CID151866013
Molecular FormulaC14H13N3
Molecular Weight223.28 g/mol
Exact Mass223.11
IUPAC Name1-benzyl-2-methylimidazo[4,5-b]pyridine
SMILESCc1nc2ncccc2n1Cc1ccccc1
InChIInChI=1S/C14H13N3/c1-11-16-14-13(8-5-9-15-14)17(11)10-12-6-3-2-4-7-12/h2-9H,10H2,1H3
InChIKeySLRRLMUCYBULNG-UHFFFAOYSA-N
XLogP2.79
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 52.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-benzyl-2,4-dimethylbenzimidazole
CID 14933027
4-[(1-benzylimidazo[4,5-b]pyridin-2-yl)amino]phenol
CID 70687050
1-[(2-chloro-3-pyridinyl)methyl]-2-methylbenzimidazole
CID 62470224
1-benzyl-N-(4-methyl-3-nitrophenyl)imidazo[4,5-b]pyridin-2-amine
CID 70697456
2-methyl-1-[(3-methyl-2-pyridinyl)methyl]benzimidazole
CID 112651453
6-iodo-2-methyl-1-(pyridin-2-ylmethyl)imidazo[4,5-b]pyridine
CID 138522273
1,3-dibenzyl-6-methyl-1,3,5-triazine-2,4-dione
CID 118357157
1-[(1-benzylimidazo[4,5-b]pyridin-2-yl)methyl]piperazin-2-one
CID 71731166
6-bromo-2-methyl-1-(pyridin-2-ylmethyl)imidazo[4,5-b]pyridine
CID 138522628
4-[(2-methylbenzimidazol-1-yl)methyl]benzoic acid
CID 6498814
4-[(2-methylbenzimidazol-1-yl)methyl]pyridine-2-carbonitrile
CID 63884032
1-benzyl-2-methyl-5-(trifluoromethyl)benzimidazole
CID 757530

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-2-methylimidazo[4,5-b]pyridine?
The IUPAC name of 1-benzyl-2-methylimidazo[4,5-b]pyridine (CID 151866013) is 1-benzyl-2-methylimidazo[4,5-b]pyridine.
What is the SMILES notation for 1-benzyl-2-methylimidazo[4,5-b]pyridine?
The canonical SMILES for 1-benzyl-2-methylimidazo[4,5-b]pyridine is Cc1nc2ncccc2n1Cc1ccccc1.
What is the InChIKey of 1-benzyl-2-methylimidazo[4,5-b]pyridine?
The InChIKey is SLRRLMUCYBULNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3/c1-11-16-14-13(8-5-9-15-14)17(11)10-12-6-3-2-4-7-12/h2-9H,10H2,1H3.
What are the key properties of 1-benzyl-2-methylimidazo[4,5-b]pyridine?
1-benzyl-2-methylimidazo[4,5-b]pyridine has a molecular weight of 223.28 g/mol, XLogP of 2.79, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-2-methylimidazo[4,5-b]pyridine is sourced from PubChem (CID 151866013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).