5-[(Z)-2-cyclohexylethenyl]pyridine-2-carbonitrile

C14H16N2 — CID 58495654

IUPAC5-[(Z)-2-cyclohexylethenyl]pyridine-2-carbonitrile
SMILESN#Cc1ccc(/C=C\C2CCCCC2)cn1
InChIInChI=1S/C14H16N2/c15-10-14-9-8-13(11-16-14)7-6-12-4-2-1-3-5-12/h6-9,11-12H,1-5H2/b7-6-
InChIKeyKLSCKBLKXADVIG-SREVYHEPSA-N
MW212.30 g/mol
LogP3.55
Rot. Bonds2

About 5-[(Z)-2-cyclohexylethenyl]pyridine-2-carbonitrile

5-[(Z)-2-cyclohexylethenyl]pyridine-2-carbonitrile (PubChem CID 58495654) has the molecular formula C14H16N2 and a molecular weight of 212.30 g/mol. Its IUPAC name is 5-[(Z)-2-cyclohexylethenyl]pyridine-2-carbonitrile.

Molecular Properties

Compound Name5-[(Z)-2-cyclohexylethenyl]pyridine-2-carbonitrile
PubChem CID58495654
Molecular FormulaC14H16N2
Molecular Weight212.30 g/mol
Exact Mass212.13
IUPAC Name5-[(Z)-2-cyclohexylethenyl]pyridine-2-carbonitrile
SMILESN#Cc1ccc(/C=C\C2CCCCC2)cn1
InChIInChI=1S/C14H16N2/c15-10-14-9-8-13(11-16-14)7-6-12-4-2-1-3-5-12/h6-9,11-12H,1-5H2/b7-6-
InChIKeyKLSCKBLKXADVIG-SREVYHEPSA-N
XLogP3.55
TPSA36.68 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.30
LogP ≤ 53.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-[(Z)-2-cyclohexylethenyl]pyridine-2-carbonitrile?
The IUPAC name of 5-[(Z)-2-cyclohexylethenyl]pyridine-2-carbonitrile (CID 58495654) is 5-[(Z)-2-cyclohexylethenyl]pyridine-2-carbonitrile.
What is the SMILES notation for 5-[(Z)-2-cyclohexylethenyl]pyridine-2-carbonitrile?
The canonical SMILES for 5-[(Z)-2-cyclohexylethenyl]pyridine-2-carbonitrile is N#Cc1ccc(/C=C\C2CCCCC2)cn1.
What is the InChIKey of 5-[(Z)-2-cyclohexylethenyl]pyridine-2-carbonitrile?
The InChIKey is KLSCKBLKXADVIG-SREVYHEPSA-N. The full InChI is InChI=1S/C14H16N2/c15-10-14-9-8-13(11-16-14)7-6-12-4-2-1-3-5-12/h6-9,11-12H,1-5H2/b7-6-.
What are the key properties of 5-[(Z)-2-cyclohexylethenyl]pyridine-2-carbonitrile?
5-[(Z)-2-cyclohexylethenyl]pyridine-2-carbonitrile has a molecular weight of 212.30 g/mol, XLogP of 3.55, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(Z)-2-cyclohexylethenyl]pyridine-2-carbonitrile is sourced from PubChem (CID 58495654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).