2-(3-cyclohexyl-1,3-dihydropyrazol-2-yl)pyridine

C14H19N3 — CID 142784086

IUPAC2-(3-cyclohexyl-1,3-dihydropyrazol-2-yl)pyridine
SMILESC1=CC(C2CCCCC2)N(c2ccccn2)N1
InChIInChI=1S/C14H19N3/c1-2-6-12(7-3-1)13-9-11-16-17(13)14-8-4-5-10-15-14/h4-5,8-13,16H,1-3,6-7H2
InChIKeyRBXOQNRKPZAUSQ-UHFFFAOYSA-N
MW229.33 g/mol
LogP2.87
Rot. Bonds2

About 2-(3-cyclohexyl-1,3-dihydropyrazol-2-yl)pyridine

2-(3-cyclohexyl-1,3-dihydropyrazol-2-yl)pyridine (PubChem CID 142784086) has the molecular formula C14H19N3 and a molecular weight of 229.33 g/mol. Its IUPAC name is 2-(3-cyclohexyl-1,3-dihydropyrazol-2-yl)pyridine.

Molecular Properties

Compound Name2-(3-cyclohexyl-1,3-dihydropyrazol-2-yl)pyridine
PubChem CID142784086
Molecular FormulaC14H19N3
Molecular Weight229.33 g/mol
Exact Mass229.16
IUPAC Name2-(3-cyclohexyl-1,3-dihydropyrazol-2-yl)pyridine
SMILESC1=CC(C2CCCCC2)N(c2ccccn2)N1
InChIInChI=1S/C14H19N3/c1-2-6-12(7-3-1)13-9-11-16-17(13)14-8-4-5-10-15-14/h4-5,8-13,16H,1-3,6-7H2
InChIKeyRBXOQNRKPZAUSQ-UHFFFAOYSA-N
XLogP2.87
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.33
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

cyclopentyl(dipyridin-2-yl)phosphane
CID 126497392
6-cyclohexyl-1-pyridin-2-ylpyridin-2-one
CID 178081614
1-(1-cyclohexylazetidin-3-yl)-4-pyridin-2-ylpiperazine
CID 126893395
4-pyridin-2-yl-1,4-diazabicyclo[3.3.2]decane
CID 69315328
1-pyridin-2-ylpiperidine-2-carbaldehyde
CID 62665226
2-cyclopropyl-5-pyridin-2-yl-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole
CID 121185571
3-pyridin-2-yl-3-azabicyclo[4.1.0]heptane
CID 169176717
N-[2-(4-pyridin-2-ylpiperazin-1-yl)propyl]cyclohexanamine
CID 13345115
6-cyclopentyl-1-pyridin-2-ylpyridin-2-one
CID 178081600
N-cycloheptyl-4-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-2-amine
CID 112898738
3-(4-pyridin-2-ylpiperazin-1-yl)azepane
CID 62642071
dicyclohexyl(2-pyridin-2-ylethyl)phosphane
CID 15721276

Frequently Asked Questions

What is the IUPAC name of 2-(3-cyclohexyl-1,3-dihydropyrazol-2-yl)pyridine?
The IUPAC name of 2-(3-cyclohexyl-1,3-dihydropyrazol-2-yl)pyridine (CID 142784086) is 2-(3-cyclohexyl-1,3-dihydropyrazol-2-yl)pyridine.
What is the SMILES notation for 2-(3-cyclohexyl-1,3-dihydropyrazol-2-yl)pyridine?
The canonical SMILES for 2-(3-cyclohexyl-1,3-dihydropyrazol-2-yl)pyridine is C1=CC(C2CCCCC2)N(c2ccccn2)N1.
What is the InChIKey of 2-(3-cyclohexyl-1,3-dihydropyrazol-2-yl)pyridine?
The InChIKey is RBXOQNRKPZAUSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3/c1-2-6-12(7-3-1)13-9-11-16-17(13)14-8-4-5-10-15-14/h4-5,8-13,16H,1-3,6-7H2.
What are the key properties of 2-(3-cyclohexyl-1,3-dihydropyrazol-2-yl)pyridine?
2-(3-cyclohexyl-1,3-dihydropyrazol-2-yl)pyridine has a molecular weight of 229.33 g/mol, XLogP of 2.87, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-cyclohexyl-1,3-dihydropyrazol-2-yl)pyridine is sourced from PubChem (CID 142784086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).