1-cyclohexyl-4-methylpyrazol-3-amine

C10H17N3 — CID 62678120

IUPAC1-cyclohexyl-4-methylpyrazol-3-amine
SMILESCc1cn(C2CCCCC2)nc1N
InChIInChI=1S/C10H17N3/c1-8-7-13(12-10(8)11)9-5-3-2-4-6-9/h7,9H,2-6H2,1H3,(H2,11,12)
InChIKeyWSBHQXLWXOJBLD-UHFFFAOYSA-N
MW179.27 g/mol
LogP2.28
Rot. Bonds1

About 1-cyclohexyl-4-methylpyrazol-3-amine

1-cyclohexyl-4-methylpyrazol-3-amine (PubChem CID 62678120) has the molecular formula C10H17N3 and a molecular weight of 179.27 g/mol. Its IUPAC name is 1-cyclohexyl-4-methylpyrazol-3-amine.

Molecular Properties

Compound Name1-cyclohexyl-4-methylpyrazol-3-amine
PubChem CID62678120
Molecular FormulaC10H17N3
Molecular Weight179.27 g/mol
Exact Mass179.14
IUPAC Name1-cyclohexyl-4-methylpyrazol-3-amine
SMILESCc1cn(C2CCCCC2)nc1N
InChIInChI=1S/C10H17N3/c1-8-7-13(12-10(8)11)9-5-3-2-4-6-9/h7,9H,2-6H2,1H3,(H2,11,12)
InChIKeyWSBHQXLWXOJBLD-UHFFFAOYSA-N
XLogP2.28
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.27
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-4-methylpyrazol-3-amine?
The IUPAC name of 1-cyclohexyl-4-methylpyrazol-3-amine (CID 62678120) is 1-cyclohexyl-4-methylpyrazol-3-amine.
What is the SMILES notation for 1-cyclohexyl-4-methylpyrazol-3-amine?
The canonical SMILES for 1-cyclohexyl-4-methylpyrazol-3-amine is Cc1cn(C2CCCCC2)nc1N.
What is the InChIKey of 1-cyclohexyl-4-methylpyrazol-3-amine?
The InChIKey is WSBHQXLWXOJBLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3/c1-8-7-13(12-10(8)11)9-5-3-2-4-6-9/h7,9H,2-6H2,1H3,(H2,11,12).
What are the key properties of 1-cyclohexyl-4-methylpyrazol-3-amine?
1-cyclohexyl-4-methylpyrazol-3-amine has a molecular weight of 179.27 g/mol, XLogP of 2.28, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-4-methylpyrazol-3-amine is sourced from PubChem (CID 62678120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).