3-(4-methyl-2-pyridinyl)-[1]benzofuro[2,3-b]pyridine

C17H12N2O — CID 90140779

IUPAC3-(4-methyl-2-pyridinyl)-[1]benzofuro[2,3-b]pyridine
SMILESCc1ccnc(-c2cnc3oc4ccccc4c3c2)c1
InChIInChI=1S/C17H12N2O/c1-11-6-7-18-15(8-11)12-9-14-13-4-2-3-5-16(13)20-17(14)19-10-12/h2-10H,1H3
InChIKeyQBZNLMYYGWFNPV-UHFFFAOYSA-N
MW260.30 g/mol
LogP4.35
Rot. Bonds1

About 3-(4-methyl-2-pyridinyl)-[1]benzofuro[2,3-b]pyridine

3-(4-methyl-2-pyridinyl)-[1]benzofuro[2,3-b]pyridine (PubChem CID 90140779) has the molecular formula C17H12N2O and a molecular weight of 260.30 g/mol. Its IUPAC name is 3-(4-methyl-2-pyridinyl)-[1]benzofuro[2,3-b]pyridine.

Molecular Properties

Compound Name3-(4-methyl-2-pyridinyl)-[1]benzofuro[2,3-b]pyridine
PubChem CID90140779
Molecular FormulaC17H12N2O
Molecular Weight260.30 g/mol
Exact Mass260.09
IUPAC Name3-(4-methyl-2-pyridinyl)-[1]benzofuro[2,3-b]pyridine
SMILESCc1ccnc(-c2cnc3oc4ccccc4c3c2)c1
InChIInChI=1S/C17H12N2O/c1-11-6-7-18-15(8-11)12-9-14-13-4-2-3-5-16(13)20-17(14)19-10-12/h2-10H,1H3
InChIKeyQBZNLMYYGWFNPV-UHFFFAOYSA-N
XLogP4.35
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.30
LogP ≤ 54.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2,3-Diphenyl-N-(2-piperazin-1-ylethyl)furo(2,3-B)pyridin-4-amine
CID 11553058
4-{[6-(2-{2-[(2R)-methylpyrrolidinyl]ethyl}-1-benzofuran-5-yl)-3-pyridinyl]carbonyl}morpholine
CID 44374493
4-(2-Benzofuranyl)pyridine
CID 65590
(-)-Dimethyl-{2-[3-((R)-1-pyridin-2-yl-ethyl)-benzofuran-2-yl]-ethyl}-amine
CID 44247935
2-(4-Methylquinolin-6-yl)-1,3-benzoxazole
CID 2421435
3-(Benzofuran-2-ylmethylene)anabaseine
CID 10338609
4-[(6-{2-[2-(4-Methyl-1-piperidinyl)ethyl]-1-benzofuran-5-yl}-3-pyridinyl)carbonyl]morpholine
CID 22274462
4-[(6-{2-[2-(1-Piperidinyl)ethyl]-1-benzofuran-5-yl}-3-pyridinyl)carbonyl]morpholine
CID 22274469
4-{[6-(2-{2-[1-Azepanyl]ethyl}-1-benzofuran-5-yl)-3-pyridinyl]carbonyl}morpholine
CID 22274472
4-[(6-{2-[2-(1-Pyrrolidinyl)ethyl]-1-benzofuran-5-yl}-3-pyridinyl)carbonyl]morpholine
CID 22274481
4-[(6-{2-[2-(4-Morpholinyl)ethyl]-1-benzofuran-5-yl}-3-pyridinyl)carbonyl]morpholine
CID 22274699
(6-{2-[2-((2R,5R)-2,5-Dimethyl-pyrrolidin-1-yl)-ethyl]-benzofuran-5-yl}-pyridin-3-yl)-morpholin-4-yl-methanone
CID 44374695

Frequently Asked Questions

What is the IUPAC name of 3-(4-methyl-2-pyridinyl)-[1]benzofuro[2,3-b]pyridine?
The IUPAC name of 3-(4-methyl-2-pyridinyl)-[1]benzofuro[2,3-b]pyridine (CID 90140779) is 3-(4-methyl-2-pyridinyl)-[1]benzofuro[2,3-b]pyridine.
What is the SMILES notation for 3-(4-methyl-2-pyridinyl)-[1]benzofuro[2,3-b]pyridine?
The canonical SMILES for 3-(4-methyl-2-pyridinyl)-[1]benzofuro[2,3-b]pyridine is Cc1ccnc(-c2cnc3oc4ccccc4c3c2)c1.
What is the InChIKey of 3-(4-methyl-2-pyridinyl)-[1]benzofuro[2,3-b]pyridine?
The InChIKey is QBZNLMYYGWFNPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12N2O/c1-11-6-7-18-15(8-11)12-9-14-13-4-2-3-5-16(13)20-17(14)19-10-12/h2-10H,1H3.
What are the key properties of 3-(4-methyl-2-pyridinyl)-[1]benzofuro[2,3-b]pyridine?
3-(4-methyl-2-pyridinyl)-[1]benzofuro[2,3-b]pyridine has a molecular weight of 260.30 g/mol, XLogP of 4.35, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methyl-2-pyridinyl)-[1]benzofuro[2,3-b]pyridine is sourced from PubChem (CID 90140779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).