3-cyclohexyl-1-ethylpyrazol-4-amine

C11H19N3 — CID 83217071

IUPAC3-cyclohexyl-1-ethylpyrazol-4-amine
SMILESCCn1cc(N)c(C2CCCCC2)n1
InChIInChI=1S/C11H19N3/c1-2-14-8-10(12)11(13-14)9-6-4-3-5-7-9/h8-9H,2-7,12H2,1H3
InChIKeyAGGQELIKYTXQGM-UHFFFAOYSA-N
MW193.29 g/mol
LogP2.53
Rot. Bonds2

About 3-cyclohexyl-1-ethylpyrazol-4-amine

3-cyclohexyl-1-ethylpyrazol-4-amine (PubChem CID 83217071) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is 3-cyclohexyl-1-ethylpyrazol-4-amine.

Molecular Properties

Compound Name3-cyclohexyl-1-ethylpyrazol-4-amine
PubChem CID83217071
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC Name3-cyclohexyl-1-ethylpyrazol-4-amine
SMILESCCn1cc(N)c(C2CCCCC2)n1
InChIInChI=1S/C11H19N3/c1-2-14-8-10(12)11(13-14)9-6-4-3-5-7-9/h8-9H,2-7,12H2,1H3
InChIKeyAGGQELIKYTXQGM-UHFFFAOYSA-N
XLogP2.53
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-cyclohexyl-1-ethylpyrazol-4-amine?
The IUPAC name of 3-cyclohexyl-1-ethylpyrazol-4-amine (CID 83217071) is 3-cyclohexyl-1-ethylpyrazol-4-amine.
What is the SMILES notation for 3-cyclohexyl-1-ethylpyrazol-4-amine?
The canonical SMILES for 3-cyclohexyl-1-ethylpyrazol-4-amine is CCn1cc(N)c(C2CCCCC2)n1.
What is the InChIKey of 3-cyclohexyl-1-ethylpyrazol-4-amine?
The InChIKey is AGGQELIKYTXQGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c1-2-14-8-10(12)11(13-14)9-6-4-3-5-7-9/h8-9H,2-7,12H2,1H3.
What are the key properties of 3-cyclohexyl-1-ethylpyrazol-4-amine?
3-cyclohexyl-1-ethylpyrazol-4-amine has a molecular weight of 193.29 g/mol, XLogP of 2.53, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexyl-1-ethylpyrazol-4-amine is sourced from PubChem (CID 83217071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).