3-cyclohexyl-2-methyl-1,5-dihydropyrazole

C10H18N2 — CID 174734952

IUPAC3-cyclohexyl-2-methyl-1,5-dihydropyrazole
SMILESCN1NCC=C1C1CCCCC1
InChIInChI=1S/C10H18N2/c1-12-10(7-8-11-12)9-5-3-2-4-6-9/h7,9,11H,2-6,8H2,1H3
InChIKeyVSNXDDJMMQBQKR-UHFFFAOYSA-N
MW166.27 g/mol
LogP1.90
Rot. Bonds1

About 3-cyclohexyl-2-methyl-1,5-dihydropyrazole

3-cyclohexyl-2-methyl-1,5-dihydropyrazole (PubChem CID 174734952) has the molecular formula C10H18N2 and a molecular weight of 166.27 g/mol. Its IUPAC name is 3-cyclohexyl-2-methyl-1,5-dihydropyrazole.

Molecular Properties

Compound Name3-cyclohexyl-2-methyl-1,5-dihydropyrazole
PubChem CID174734952
Molecular FormulaC10H18N2
Molecular Weight166.27 g/mol
Exact Mass166.15
IUPAC Name3-cyclohexyl-2-methyl-1,5-dihydropyrazole
SMILESCN1NCC=C1C1CCCCC1
InChIInChI=1S/C10H18N2/c1-12-10(7-8-11-12)9-5-3-2-4-6-9/h7,9,11H,2-6,8H2,1H3
InChIKeyVSNXDDJMMQBQKR-UHFFFAOYSA-N
XLogP1.90
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.27
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-cyclohexyl-2-methyl-1,5-dihydropyrazole?
The IUPAC name of 3-cyclohexyl-2-methyl-1,5-dihydropyrazole (CID 174734952) is 3-cyclohexyl-2-methyl-1,5-dihydropyrazole.
What is the SMILES notation for 3-cyclohexyl-2-methyl-1,5-dihydropyrazole?
The canonical SMILES for 3-cyclohexyl-2-methyl-1,5-dihydropyrazole is CN1NCC=C1C1CCCCC1.
What is the InChIKey of 3-cyclohexyl-2-methyl-1,5-dihydropyrazole?
The InChIKey is VSNXDDJMMQBQKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2/c1-12-10(7-8-11-12)9-5-3-2-4-6-9/h7,9,11H,2-6,8H2,1H3.
What are the key properties of 3-cyclohexyl-2-methyl-1,5-dihydropyrazole?
3-cyclohexyl-2-methyl-1,5-dihydropyrazole has a molecular weight of 166.27 g/mol, XLogP of 1.90, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexyl-2-methyl-1,5-dihydropyrazole is sourced from PubChem (CID 174734952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).