2,7-dimethyl-[1]benzofuro[2,3-b]pyridine

C13H11NO — CID 122520461

IUPAC2,7-dimethyl-[1]benzofuro[2,3-b]pyridine
SMILESCc1ccc2c(c1)oc1nc(C)ccc12
InChIInChI=1S/C13H11NO/c1-8-3-5-10-11-6-4-9(2)14-13(11)15-12(10)7-8/h3-7H,1-2H3
InChIKeyIVRNJQNOPMGCCO-UHFFFAOYSA-N
MW197.24 g/mol
LogP3.60
Rot. Bonds

About 2,7-dimethyl-[1]benzofuro[2,3-b]pyridine

2,7-dimethyl-[1]benzofuro[2,3-b]pyridine (PubChem CID 122520461) has the molecular formula C13H11NO and a molecular weight of 197.24 g/mol. Its IUPAC name is 2,7-dimethyl-[1]benzofuro[2,3-b]pyridine.

Molecular Properties

Compound Name2,7-dimethyl-[1]benzofuro[2,3-b]pyridine
PubChem CID122520461
Molecular FormulaC13H11NO
Molecular Weight197.24 g/mol
Exact Mass197.08
IUPAC Name2,7-dimethyl-[1]benzofuro[2,3-b]pyridine
SMILESCc1ccc2c(c1)oc1nc(C)ccc12
InChIInChI=1S/C13H11NO/c1-8-3-5-10-11-6-4-9(2)14-13(11)15-12(10)7-8/h3-7H,1-2H3
InChIKeyIVRNJQNOPMGCCO-UHFFFAOYSA-N
XLogP3.60
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.24
LogP ≤ 53.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2,7-dimethylpyrano[2,3-b]pyridin-4-one
CID 169285034
2-methyl-8-(7-methyldibenzofuran-2-yl)dibenzofuran
CID 59359477
7-acetyl-2-methylchromeno[2,3-b]pyridin-5-one
CID 12898481
9-methylphenanthro[1,2-b][1]benzofuran
CID 158951107
2,4-diamino-8-methyl-5-oxochromeno[2,3-b]pyridine-3-carbonitrile
CID 71725756
3,6-dimethyldibenzofuran;ethane
CID 142097287
19-methyl-16-oxahexacyclo[12.11.0.02,7.08,13.015,23.017,22]pentacosa-1(14),2,4,6,8,10,12,15(23),17(22),18,20,24-dodecaene
CID 123734566
2,7-dimethylchromen-4-one
CID 2343140
6-methyl-3-(methylamino)furo[2,3-b]pyridine-2-carbaldehyde
CID 143374958
dimethyl-[6-(2-methyl-[1]benzofuro[2,3-b]pyridin-6-yl)-3-pyridinyl]-phenylsilane
CID 140720059
2-methoxy-7-methyldibenzofuran
CID 122387372
6-[5-(cyclopentylmethyl)-4-methyl-2-pyridinyl]-2,7-dimethyl-[1]benzofuro[2,3-b]pyridine
CID 171435884

Frequently Asked Questions

What is the IUPAC name of 2,7-dimethyl-[1]benzofuro[2,3-b]pyridine?
The IUPAC name of 2,7-dimethyl-[1]benzofuro[2,3-b]pyridine (CID 122520461) is 2,7-dimethyl-[1]benzofuro[2,3-b]pyridine.
What is the SMILES notation for 2,7-dimethyl-[1]benzofuro[2,3-b]pyridine?
The canonical SMILES for 2,7-dimethyl-[1]benzofuro[2,3-b]pyridine is Cc1ccc2c(c1)oc1nc(C)ccc12.
What is the InChIKey of 2,7-dimethyl-[1]benzofuro[2,3-b]pyridine?
The InChIKey is IVRNJQNOPMGCCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11NO/c1-8-3-5-10-11-6-4-9(2)14-13(11)15-12(10)7-8/h3-7H,1-2H3.
What are the key properties of 2,7-dimethyl-[1]benzofuro[2,3-b]pyridine?
2,7-dimethyl-[1]benzofuro[2,3-b]pyridine has a molecular weight of 197.24 g/mol, XLogP of 3.60, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,7-dimethyl-[1]benzofuro[2,3-b]pyridine is sourced from PubChem (CID 122520461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).