4,6-dimethylfuro[2,3-b]pyridine-5-carbonitrile

C10H8N2O — CID 176758393

IUPAC4,6-dimethylfuro[2,3-b]pyridine-5-carbonitrile
SMILESCc1nc2occc2c(C)c1C#N
InChIInChI=1S/C10H8N2O/c1-6-8-3-4-13-10(8)12-7(2)9(6)5-11/h3-4H,1-2H3
InChIKeySNVFEZVERLVMAL-UHFFFAOYSA-N
MW172.19 g/mol
LogP2.32
Rot. Bonds

About 4,6-dimethylfuro[2,3-b]pyridine-5-carbonitrile

4,6-dimethylfuro[2,3-b]pyridine-5-carbonitrile (PubChem CID 176758393) has the molecular formula C10H8N2O and a molecular weight of 172.19 g/mol. Its IUPAC name is 4,6-dimethylfuro[2,3-b]pyridine-5-carbonitrile.

Molecular Properties

Compound Name4,6-dimethylfuro[2,3-b]pyridine-5-carbonitrile
PubChem CID176758393
Molecular FormulaC10H8N2O
Molecular Weight172.19 g/mol
Exact Mass172.06
IUPAC Name4,6-dimethylfuro[2,3-b]pyridine-5-carbonitrile
SMILESCc1nc2occc2c(C)c1C#N
InChIInChI=1S/C10H8N2O/c1-6-8-3-4-13-10(8)12-7(2)9(6)5-11/h3-4H,1-2H3
InChIKeySNVFEZVERLVMAL-UHFFFAOYSA-N
XLogP2.32
TPSA49.82 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.19
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

6-chlorofuro[2,3-b]quinoline-4-carbonitrile
CID 86170575
2,6-dimethyl-4-[methyl-[(2-methylfuran-3-yl)methyl]amino]pyridine-3-carbonitrile
CID 81060176
2-ethyl-4-methylfuro[2,3-d]pyrimidine
CID 137452302
2,6-dimethylfuro[2,3-d]pyrimidine-5-carbonitrile
CID 82411697
5,6-diamino-2,4-dimethylpyridine-3-carbonitrile
CID 54463519
1,3-dimethyl-5-(2-methylfuran-3-yl)sulfanylpyrazole-4-carbonitrile
CID 107780125
3-methylbenzene-1,2,4-tricarbonitrile
CID 54234334
1-methylisoquinoline-3,4-dicarbonitrile
CID 89141379
4-[(E)-2-(dimethylamino)ethenyl]-2,6-dimethylpyridine-3-carbonitrile
CID 143841340
3-methylfuro[2,3-e][1,2,4]triazine
CID 162890435
4,8-dimethylfuro[2,3-f][1]benzofuran
CID 130182469
10-methylanthracene-9-carbonitrile
CID 12617916

Frequently Asked Questions

What is the IUPAC name of 4,6-dimethylfuro[2,3-b]pyridine-5-carbonitrile?
The IUPAC name of 4,6-dimethylfuro[2,3-b]pyridine-5-carbonitrile (CID 176758393) is 4,6-dimethylfuro[2,3-b]pyridine-5-carbonitrile.
What is the SMILES notation for 4,6-dimethylfuro[2,3-b]pyridine-5-carbonitrile?
The canonical SMILES for 4,6-dimethylfuro[2,3-b]pyridine-5-carbonitrile is Cc1nc2occc2c(C)c1C#N.
What is the InChIKey of 4,6-dimethylfuro[2,3-b]pyridine-5-carbonitrile?
The InChIKey is SNVFEZVERLVMAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N2O/c1-6-8-3-4-13-10(8)12-7(2)9(6)5-11/h3-4H,1-2H3.
What are the key properties of 4,6-dimethylfuro[2,3-b]pyridine-5-carbonitrile?
4,6-dimethylfuro[2,3-b]pyridine-5-carbonitrile has a molecular weight of 172.19 g/mol, XLogP of 2.32, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dimethylfuro[2,3-b]pyridine-5-carbonitrile is sourced from PubChem (CID 176758393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).