2-ethyl-4,6-dihydrofuro[3,4-c]pyrazole-3-carbonitrile

C8H9N3O — CID 105432065

IUPAC2-ethyl-4,6-dihydrofuro[3,4-c]pyrazole-3-carbonitrile
SMILESCCn1nc2c(c1C#N)COC2
InChIInChI=1S/C8H9N3O/c1-2-11-8(3-9)6-4-12-5-7(6)10-11/h2,4-5H2,1H3
InChIKeyZFHHJYBDNVRJPX-UHFFFAOYSA-N
MW163.18 g/mol
LogP0.80
Rot. Bonds1

About 2-ethyl-4,6-dihydrofuro[3,4-c]pyrazole-3-carbonitrile

2-ethyl-4,6-dihydrofuro[3,4-c]pyrazole-3-carbonitrile (PubChem CID 105432065) has the molecular formula C8H9N3O and a molecular weight of 163.18 g/mol. Its IUPAC name is 2-ethyl-4,6-dihydrofuro[3,4-c]pyrazole-3-carbonitrile.

Molecular Properties

Compound Name2-ethyl-4,6-dihydrofuro[3,4-c]pyrazole-3-carbonitrile
PubChem CID105432065
Molecular FormulaC8H9N3O
Molecular Weight163.18 g/mol
Exact Mass163.07
IUPAC Name2-ethyl-4,6-dihydrofuro[3,4-c]pyrazole-3-carbonitrile
SMILESCCn1nc2c(c1C#N)COC2
InChIInChI=1S/C8H9N3O/c1-2-11-8(3-9)6-4-12-5-7(6)10-11/h2,4-5H2,1H3
InChIKeyZFHHJYBDNVRJPX-UHFFFAOYSA-N
XLogP0.80
TPSA50.84 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.18
LogP ≤ 50.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-cyclobutyl-4,6-dihydrofuro[3,4-c]pyrazole-3-carbonitrile
CID 105443534
2-cycloheptyl-4,6-dihydrofuro[3,4-c]pyrazole-3-carbonitrile
CID 105489761
2-ethyl-4,6-dihydrofuro[3,4-c]pyrazole-3-carboxylic acid
CID 105439884
2-piperidin-4-yl-4,6-dihydrofuro[3,4-c]pyrazole-3-carbonitrile
CID 105472552
2-(3-hydroxyphenyl)-4,6-dihydrofuro[3,4-c]pyrazole-3-carbonitrile
CID 105484408
2-methyl-4,6-dihydrofuro[3,4-c]pyrazol-3-amine
CID 83679999
2-phenyl-5,7-dihydro-4H-pyrano[3,4-c]pyrazole-3-carbonitrile
CID 105482909
2-ethyl-4-fluoroindazole-3-carbonitrile
CID 84719232
(2-propan-2-yl-4,6-dihydrofuro[3,4-c]pyrazol-3-yl)methanamine
CID 112711083
1-tert-butyl-4,6-dihydrofuro[3,4-d]pyrazole-3-carbonitrile
CID 105445015
2-(oxan-4-yl)-5,6-dihydro-4H-cyclopenta[c]pyrazole-3-carbonitrile
CID 105471198
3-ethyl-5-propan-2-yltriazole-4-carbonitrile
CID 69383690

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-4,6-dihydrofuro[3,4-c]pyrazole-3-carbonitrile?
The IUPAC name of 2-ethyl-4,6-dihydrofuro[3,4-c]pyrazole-3-carbonitrile (CID 105432065) is 2-ethyl-4,6-dihydrofuro[3,4-c]pyrazole-3-carbonitrile.
What is the SMILES notation for 2-ethyl-4,6-dihydrofuro[3,4-c]pyrazole-3-carbonitrile?
The canonical SMILES for 2-ethyl-4,6-dihydrofuro[3,4-c]pyrazole-3-carbonitrile is CCn1nc2c(c1C#N)COC2.
What is the InChIKey of 2-ethyl-4,6-dihydrofuro[3,4-c]pyrazole-3-carbonitrile?
The InChIKey is ZFHHJYBDNVRJPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N3O/c1-2-11-8(3-9)6-4-12-5-7(6)10-11/h2,4-5H2,1H3.
What are the key properties of 2-ethyl-4,6-dihydrofuro[3,4-c]pyrazole-3-carbonitrile?
2-ethyl-4,6-dihydrofuro[3,4-c]pyrazole-3-carbonitrile has a molecular weight of 163.18 g/mol, XLogP of 0.80, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-4,6-dihydrofuro[3,4-c]pyrazole-3-carbonitrile is sourced from PubChem (CID 105432065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).