3-(1-ethylpyrazol-4-yl)oxypyridine-4-carbonitrile

C11H10N4O — CID 116801198

IUPAC3-(1-ethylpyrazol-4-yl)oxypyridine-4-carbonitrile
SMILESCCn1cc(Oc2cnccc2C#N)cn1
InChIInChI=1S/C11H10N4O/c1-2-15-8-10(6-14-15)16-11-7-13-4-3-9(11)5-12/h3-4,6-8H,2H2,1H3
InChIKeyUGURQSQNUPYJJJ-UHFFFAOYSA-N
MW214.23 g/mol
LogP1.96
Rot. Bonds3

About 3-(1-ethylpyrazol-4-yl)oxypyridine-4-carbonitrile

3-(1-ethylpyrazol-4-yl)oxypyridine-4-carbonitrile (PubChem CID 116801198) has the molecular formula C11H10N4O and a molecular weight of 214.23 g/mol. Its IUPAC name is 3-(1-ethylpyrazol-4-yl)oxypyridine-4-carbonitrile.

Molecular Properties

Compound Name3-(1-ethylpyrazol-4-yl)oxypyridine-4-carbonitrile
PubChem CID116801198
Molecular FormulaC11H10N4O
Molecular Weight214.23 g/mol
Exact Mass214.09
IUPAC Name3-(1-ethylpyrazol-4-yl)oxypyridine-4-carbonitrile
SMILESCCn1cc(Oc2cnccc2C#N)cn1
InChIInChI=1S/C11H10N4O/c1-2-15-8-10(6-14-15)16-11-7-13-4-3-9(11)5-12/h3-4,6-8H,2H2,1H3
InChIKeyUGURQSQNUPYJJJ-UHFFFAOYSA-N
XLogP1.96
TPSA63.73 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.23
LogP ≤ 51.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

3-(1-ethylpyrazol-4-yl)oxypyridine-4-carbothioamide
CID 116801318
3-bromo-4-(1-ethylpyrazol-4-yl)oxybenzonitrile
CID 116801191
4-(1-ethylpyrazol-4-yl)oxy-2-(trifluoromethyl)benzonitrile
CID 116801192
3-[4-(cyanomethyl)phenoxy]pyridine-4-carbonitrile
CID 114287836
3-[(6-methyl-3-pyridinyl)oxy]pyridine-4-carbonitrile
CID 114287943
3-propoxypyridine-4-carbonitrile
CID 19432765
5-fluoro-2-(1-propylpyrazol-4-yl)oxybenzonitrile
CID 116801252
5-[(1-ethylpyrazol-4-yl)oxymethyl]-2-fluorobenzonitrile
CID 114013035
2-bromo-3-fluoro-4-(1-propylpyrazol-4-yl)oxybenzonitrile
CID 107534446
5-amino-6-(1-ethylpyrazol-4-yl)oxypyridine-3-carbonitrile
CID 103469812
3-(3-chloro-4-fluorophenoxy)pyridine-4-carbonitrile
CID 114287961
3-butan-2-yloxypyridine-4-carbonitrile
CID 19432811

Frequently Asked Questions

What is the IUPAC name of 3-(1-ethylpyrazol-4-yl)oxypyridine-4-carbonitrile?
The IUPAC name of 3-(1-ethylpyrazol-4-yl)oxypyridine-4-carbonitrile (CID 116801198) is 3-(1-ethylpyrazol-4-yl)oxypyridine-4-carbonitrile.
What is the SMILES notation for 3-(1-ethylpyrazol-4-yl)oxypyridine-4-carbonitrile?
The canonical SMILES for 3-(1-ethylpyrazol-4-yl)oxypyridine-4-carbonitrile is CCn1cc(Oc2cnccc2C#N)cn1.
What is the InChIKey of 3-(1-ethylpyrazol-4-yl)oxypyridine-4-carbonitrile?
The InChIKey is UGURQSQNUPYJJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N4O/c1-2-15-8-10(6-14-15)16-11-7-13-4-3-9(11)5-12/h3-4,6-8H,2H2,1H3.
What are the key properties of 3-(1-ethylpyrazol-4-yl)oxypyridine-4-carbonitrile?
3-(1-ethylpyrazol-4-yl)oxypyridine-4-carbonitrile has a molecular weight of 214.23 g/mol, XLogP of 1.96, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-ethylpyrazol-4-yl)oxypyridine-4-carbonitrile is sourced from PubChem (CID 116801198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).