2-(3-cyclopropylpyrazol-1-yl)pyridine-4-carbonitrile

C12H10N4 — CID 62487092

IUPAC2-(3-cyclopropylpyrazol-1-yl)pyridine-4-carbonitrile
SMILESN#Cc1ccnc(-n2ccc(C3CC3)n2)c1
InChIInChI=1S/C12H10N4/c13-8-9-3-5-14-12(7-9)16-6-4-11(15-16)10-1-2-10/h3-7,10H,1-2H2
InChIKeyOOHVZVWQGQOSDW-UHFFFAOYSA-N
MW210.24 g/mol
LogP2.02
Rot. Bonds2

About 2-(3-cyclopropylpyrazol-1-yl)pyridine-4-carbonitrile

2-(3-cyclopropylpyrazol-1-yl)pyridine-4-carbonitrile (PubChem CID 62487092) has the molecular formula C12H10N4 and a molecular weight of 210.24 g/mol. Its IUPAC name is 2-(3-cyclopropylpyrazol-1-yl)pyridine-4-carbonitrile.

Molecular Properties

Compound Name2-(3-cyclopropylpyrazol-1-yl)pyridine-4-carbonitrile
PubChem CID62487092
Molecular FormulaC12H10N4
Molecular Weight210.24 g/mol
Exact Mass210.09
IUPAC Name2-(3-cyclopropylpyrazol-1-yl)pyridine-4-carbonitrile
SMILESN#Cc1ccnc(-n2ccc(C3CC3)n2)c1
InChIInChI=1S/C12H10N4/c13-8-9-3-5-14-12(7-9)16-6-4-11(15-16)10-1-2-10/h3-7,10H,1-2H2
InChIKeyOOHVZVWQGQOSDW-UHFFFAOYSA-N
XLogP2.02
TPSA54.50 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.24
LogP ≤ 52.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(3-cyclopropylpyrazol-1-yl)pyridine-4-carbonitrile?
The IUPAC name of 2-(3-cyclopropylpyrazol-1-yl)pyridine-4-carbonitrile (CID 62487092) is 2-(3-cyclopropylpyrazol-1-yl)pyridine-4-carbonitrile.
What is the SMILES notation for 2-(3-cyclopropylpyrazol-1-yl)pyridine-4-carbonitrile?
The canonical SMILES for 2-(3-cyclopropylpyrazol-1-yl)pyridine-4-carbonitrile is N#Cc1ccnc(-n2ccc(C3CC3)n2)c1.
What is the InChIKey of 2-(3-cyclopropylpyrazol-1-yl)pyridine-4-carbonitrile?
The InChIKey is OOHVZVWQGQOSDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N4/c13-8-9-3-5-14-12(7-9)16-6-4-11(15-16)10-1-2-10/h3-7,10H,1-2H2.
What are the key properties of 2-(3-cyclopropylpyrazol-1-yl)pyridine-4-carbonitrile?
2-(3-cyclopropylpyrazol-1-yl)pyridine-4-carbonitrile has a molecular weight of 210.24 g/mol, XLogP of 2.02, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-cyclopropylpyrazol-1-yl)pyridine-4-carbonitrile is sourced from PubChem (CID 62487092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).