6-methyl-2-(5-methylfuran-3-yl)-1H-imidazo[4,5-b]pyridine

C12H11N3O — CID 114821625

IUPAC6-methyl-2-(5-methylfuran-3-yl)-1H-imidazo[4,5-b]pyridine
SMILESCc1cnc2nc(-c3coc(C)c3)[nH]c2c1
InChIInChI=1S/C12H11N3O/c1-7-3-10-12(13-5-7)15-11(14-10)9-4-8(2)16-6-9/h3-6H,1-2H3,(H,13,14,15)
InChIKeyXVRHRWHLYXJYMY-UHFFFAOYSA-N
MW213.24 g/mol
LogP2.83
Rot. Bonds1

About 6-methyl-2-(5-methylfuran-3-yl)-1H-imidazo[4,5-b]pyridine

6-methyl-2-(5-methylfuran-3-yl)-1H-imidazo[4,5-b]pyridine (PubChem CID 114821625) has the molecular formula C12H11N3O and a molecular weight of 213.24 g/mol. Its IUPAC name is 6-methyl-2-(5-methylfuran-3-yl)-1H-imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name6-methyl-2-(5-methylfuran-3-yl)-1H-imidazo[4,5-b]pyridine
PubChem CID114821625
Molecular FormulaC12H11N3O
Molecular Weight213.24 g/mol
Exact Mass213.09
IUPAC Name6-methyl-2-(5-methylfuran-3-yl)-1H-imidazo[4,5-b]pyridine
SMILESCc1cnc2nc(-c3coc(C)c3)[nH]c2c1
InChIInChI=1S/C12H11N3O/c1-7-3-10-12(13-5-7)15-11(14-10)9-4-8(2)16-6-9/h3-6H,1-2H3,(H,13,14,15)
InChIKeyXVRHRWHLYXJYMY-UHFFFAOYSA-N
XLogP2.83
TPSA54.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.24
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

8-(5-methylfuran-3-yl)-7H-purine
CID 114821646
6-methyl-2-phenyl-1H-imidazo[4,5-b]pyridine
CID 79015212
6-methyl-2-pyridin-3-yl-1H-imidazo[4,5-b]pyridine
CID 79015085
2-(furan-2-yl)-6-methyl-1H-imidazo[4,5-b]pyridine
CID 79795542
N-methyl-4-(6-methyl-1H-imidazo[4,5-b]pyridin-2-yl)aniline
CID 104698549
2-(1,3-benzodioxol-5-yl)-6-methyl-1H-imidazo[4,5-b]pyridine
CID 79795462
2-chloro-5-(6-methyl-1H-imidazo[4,5-b]pyridin-2-yl)aniline
CID 79795619
2-bromo-5-(6-methyl-1H-imidazo[4,5-b]pyridin-2-yl)aniline
CID 114003900
2-fluoro-5-(6-methyl-1H-imidazo[4,5-b]pyridin-2-yl)aniline
CID 79795786
6-(6-methyl-1H-imidazo[4,5-b]pyridin-2-yl)quinoline
CID 79791281
2-[4-fluoro-3-(trifluoromethyl)phenyl]-6-methyl-1H-imidazo[4,5-b]pyridine
CID 79791283
2-(4,5-dimethylthiophen-2-yl)-6-methyl-1H-imidazo[4,5-b]pyridine
CID 79796382

Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-(5-methylfuran-3-yl)-1H-imidazo[4,5-b]pyridine?
The IUPAC name of 6-methyl-2-(5-methylfuran-3-yl)-1H-imidazo[4,5-b]pyridine (CID 114821625) is 6-methyl-2-(5-methylfuran-3-yl)-1H-imidazo[4,5-b]pyridine.
What is the SMILES notation for 6-methyl-2-(5-methylfuran-3-yl)-1H-imidazo[4,5-b]pyridine?
The canonical SMILES for 6-methyl-2-(5-methylfuran-3-yl)-1H-imidazo[4,5-b]pyridine is Cc1cnc2nc(-c3coc(C)c3)[nH]c2c1.
What is the InChIKey of 6-methyl-2-(5-methylfuran-3-yl)-1H-imidazo[4,5-b]pyridine?
The InChIKey is XVRHRWHLYXJYMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N3O/c1-7-3-10-12(13-5-7)15-11(14-10)9-4-8(2)16-6-9/h3-6H,1-2H3,(H,13,14,15).
What are the key properties of 6-methyl-2-(5-methylfuran-3-yl)-1H-imidazo[4,5-b]pyridine?
6-methyl-2-(5-methylfuran-3-yl)-1H-imidazo[4,5-b]pyridine has a molecular weight of 213.24 g/mol, XLogP of 2.83, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-(5-methylfuran-3-yl)-1H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 114821625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).