6-methoxyfuro[2,3-b]pyridine-5-carbonitrile

C9H6N2O2 — CID 82411525

IUPAC6-methoxyfuro[2,3-b]pyridine-5-carbonitrile
SMILESCOc1nc2occc2cc1C#N
InChIInChI=1S/C9H6N2O2/c1-12-8-7(5-10)4-6-2-3-13-9(6)11-8/h2-4H,1H3
InChIKeyGNIMRRATVVIRRX-UHFFFAOYSA-N
MW174.16 g/mol
LogP1.71
Rot. Bonds1

About 6-methoxyfuro[2,3-b]pyridine-5-carbonitrile

6-methoxyfuro[2,3-b]pyridine-5-carbonitrile (PubChem CID 82411525) has the molecular formula C9H6N2O2 and a molecular weight of 174.16 g/mol. Its IUPAC name is 6-methoxyfuro[2,3-b]pyridine-5-carbonitrile.

Molecular Properties

Compound Name6-methoxyfuro[2,3-b]pyridine-5-carbonitrile
PubChem CID82411525
Molecular FormulaC9H6N2O2
Molecular Weight174.16 g/mol
Exact Mass174.04
IUPAC Name6-methoxyfuro[2,3-b]pyridine-5-carbonitrile
SMILESCOc1nc2occc2cc1C#N
InChIInChI=1S/C9H6N2O2/c1-12-8-7(5-10)4-6-2-3-13-9(6)11-8/h2-4H,1H3
InChIKeyGNIMRRATVVIRRX-UHFFFAOYSA-N
XLogP1.71
TPSA59.05 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.16
LogP ≤ 51.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

6-methoxy-[1,2]thiazolo[5,4-b]pyridine-5-carbonitrile
CID 82403526
6-(difluoromethyl)-2-methoxy-5-methylpyridine-3-carbonitrile
CID 130077911
5-chloro-6-(difluoromethyl)-2-methoxypyridine-3-carbonitrile
CID 130071015
2-methoxypyridine-3,5-dicarbonitrile
CID 84650868
2-methoxy-8-phenylmethoxyquinoline-3-carbonitrile
CID 126622166
6-fluoro-1-benzofuran-5-carbonitrile
CID 117276102
5-(aminomethyl)-6-(difluoromethyl)-2-methoxypyridine-3-carbonitrile
CID 130077933
(6-cyano-5-methoxythieno[3,2-b]pyridin-3-yl)boronic acid
CID 142471121
5-(difluoromethyl)-6-formyl-2-methoxypyridine-3-carbonitrile
CID 130078112
1-methoxy-7-(2-methoxyethoxy)isoquinoline-6-carbonitrile
CID 126639429
furo[2,3-b]pyridine-4-carbonitrile
CID 133054098
6-(4-aminophenyl)-2-methoxypyridine-3-carbonitrile
CID 162439983

Frequently Asked Questions

What is the IUPAC name of 6-methoxyfuro[2,3-b]pyridine-5-carbonitrile?
The IUPAC name of 6-methoxyfuro[2,3-b]pyridine-5-carbonitrile (CID 82411525) is 6-methoxyfuro[2,3-b]pyridine-5-carbonitrile.
What is the SMILES notation for 6-methoxyfuro[2,3-b]pyridine-5-carbonitrile?
The canonical SMILES for 6-methoxyfuro[2,3-b]pyridine-5-carbonitrile is COc1nc2occc2cc1C#N.
What is the InChIKey of 6-methoxyfuro[2,3-b]pyridine-5-carbonitrile?
The InChIKey is GNIMRRATVVIRRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H6N2O2/c1-12-8-7(5-10)4-6-2-3-13-9(6)11-8/h2-4H,1H3.
What are the key properties of 6-methoxyfuro[2,3-b]pyridine-5-carbonitrile?
6-methoxyfuro[2,3-b]pyridine-5-carbonitrile has a molecular weight of 174.16 g/mol, XLogP of 1.71, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxyfuro[2,3-b]pyridine-5-carbonitrile is sourced from PubChem (CID 82411525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).