2-(2-methylpyrazol-3-yl)cyclohexan-1-amine

C10H17N3 — CID 63961612

IUPAC2-(2-methylpyrazol-3-yl)cyclohexan-1-amine
SMILESCn1nccc1C1CCCCC1N
InChIInChI=1S/C10H17N3/c1-13-10(6-7-12-13)8-4-2-3-5-9(8)11/h6-9H,2-5,11H2,1H3
InChIKeyJEOLEPBONRJJMP-UHFFFAOYSA-N
MW179.27 g/mol
LogP1.40
Rot. Bonds1

About 2-(2-methylpyrazol-3-yl)cyclohexan-1-amine

2-(2-methylpyrazol-3-yl)cyclohexan-1-amine (PubChem CID 63961612) has the molecular formula C10H17N3 and a molecular weight of 179.27 g/mol. Its IUPAC name is 2-(2-methylpyrazol-3-yl)cyclohexan-1-amine.

Molecular Properties

Compound Name2-(2-methylpyrazol-3-yl)cyclohexan-1-amine
PubChem CID63961612
Molecular FormulaC10H17N3
Molecular Weight179.27 g/mol
Exact Mass179.14
IUPAC Name2-(2-methylpyrazol-3-yl)cyclohexan-1-amine
SMILESCn1nccc1C1CCCCC1N
InChIInChI=1S/C10H17N3/c1-13-10(6-7-12-13)8-4-2-3-5-9(8)11/h6-9H,2-5,11H2,1H3
InChIKeyJEOLEPBONRJJMP-UHFFFAOYSA-N
XLogP1.40
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 ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methylpyrazol-3-yl)cyclohexan-1-amine?
The IUPAC name of 2-(2-methylpyrazol-3-yl)cyclohexan-1-amine (CID 63961612) is 2-(2-methylpyrazol-3-yl)cyclohexan-1-amine.
What is the SMILES notation for 2-(2-methylpyrazol-3-yl)cyclohexan-1-amine?
The canonical SMILES for 2-(2-methylpyrazol-3-yl)cyclohexan-1-amine is Cn1nccc1C1CCCCC1N.
What is the InChIKey of 2-(2-methylpyrazol-3-yl)cyclohexan-1-amine?
The InChIKey is JEOLEPBONRJJMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3/c1-13-10(6-7-12-13)8-4-2-3-5-9(8)11/h6-9H,2-5,11H2,1H3.
What are the key properties of 2-(2-methylpyrazol-3-yl)cyclohexan-1-amine?
2-(2-methylpyrazol-3-yl)cyclohexan-1-amine has a molecular weight of 179.27 g/mol, XLogP of 1.40, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylpyrazol-3-yl)cyclohexan-1-amine is sourced from PubChem (CID 63961612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).