3,5-diethyl-1-(4-ethylcyclohexyl)pyrazol-4-amine

C15H27N3 — CID 82702126

IUPAC3,5-diethyl-1-(4-ethylcyclohexyl)pyrazol-4-amine
SMILESCCc1nn(C2CCC(CC)CC2)c(CC)c1N
InChIInChI=1S/C15H27N3/c1-4-11-7-9-12(10-8-11)18-14(6-3)15(16)13(5-2)17-18/h11-12H,4-10,16H2,1-3H3
InChIKeyGCEUMEJWEFLZBH-UHFFFAOYSA-N
MW249.40 g/mol
LogP3.73
Rot. Bonds4

About 3,5-diethyl-1-(4-ethylcyclohexyl)pyrazol-4-amine

3,5-diethyl-1-(4-ethylcyclohexyl)pyrazol-4-amine (PubChem CID 82702126) has the molecular formula C15H27N3 and a molecular weight of 249.40 g/mol. Its IUPAC name is 3,5-diethyl-1-(4-ethylcyclohexyl)pyrazol-4-amine.

Molecular Properties

Compound Name3,5-diethyl-1-(4-ethylcyclohexyl)pyrazol-4-amine
PubChem CID82702126
Molecular FormulaC15H27N3
Molecular Weight249.40 g/mol
Exact Mass249.22
IUPAC Name3,5-diethyl-1-(4-ethylcyclohexyl)pyrazol-4-amine
SMILESCCc1nn(C2CCC(CC)CC2)c(CC)c1N
InChIInChI=1S/C15H27N3/c1-4-11-7-9-12(10-8-11)18-14(6-3)15(16)13(5-2)17-18/h11-12H,4-10,16H2,1-3H3
InChIKeyGCEUMEJWEFLZBH-UHFFFAOYSA-N
XLogP3.73
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.40
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3,5-diethyl-1-(4-ethylcyclohexyl)pyrazol-4-amine?
The IUPAC name of 3,5-diethyl-1-(4-ethylcyclohexyl)pyrazol-4-amine (CID 82702126) is 3,5-diethyl-1-(4-ethylcyclohexyl)pyrazol-4-amine.
What is the SMILES notation for 3,5-diethyl-1-(4-ethylcyclohexyl)pyrazol-4-amine?
The canonical SMILES for 3,5-diethyl-1-(4-ethylcyclohexyl)pyrazol-4-amine is CCc1nn(C2CCC(CC)CC2)c(CC)c1N.
What is the InChIKey of 3,5-diethyl-1-(4-ethylcyclohexyl)pyrazol-4-amine?
The InChIKey is GCEUMEJWEFLZBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3/c1-4-11-7-9-12(10-8-11)18-14(6-3)15(16)13(5-2)17-18/h11-12H,4-10,16H2,1-3H3.
What are the key properties of 3,5-diethyl-1-(4-ethylcyclohexyl)pyrazol-4-amine?
3,5-diethyl-1-(4-ethylcyclohexyl)pyrazol-4-amine has a molecular weight of 249.40 g/mol, XLogP of 3.73, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-diethyl-1-(4-ethylcyclohexyl)pyrazol-4-amine is sourced from PubChem (CID 82702126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).