3-cyclopentyl-1-(2-methylpropyl)pyrazol-4-amine

C12H21N3 — CID 83216247

IUPAC3-cyclopentyl-1-(2-methylpropyl)pyrazol-4-amine
SMILESCC(C)Cn1cc(N)c(C2CCCC2)n1
InChIInChI=1S/C12H21N3/c1-9(2)7-15-8-11(13)12(14-15)10-5-3-4-6-10/h8-10H,3-7,13H2,1-2H3
InChIKeyNUSNMGMMYKPBEK-UHFFFAOYSA-N
MW207.32 g/mol
LogP2.78
Rot. Bonds3

About 3-cyclopentyl-1-(2-methylpropyl)pyrazol-4-amine

3-cyclopentyl-1-(2-methylpropyl)pyrazol-4-amine (PubChem CID 83216247) has the molecular formula C12H21N3 and a molecular weight of 207.32 g/mol. Its IUPAC name is 3-cyclopentyl-1-(2-methylpropyl)pyrazol-4-amine.

Molecular Properties

Compound Name3-cyclopentyl-1-(2-methylpropyl)pyrazol-4-amine
PubChem CID83216247
Molecular FormulaC12H21N3
Molecular Weight207.32 g/mol
Exact Mass207.17
IUPAC Name3-cyclopentyl-1-(2-methylpropyl)pyrazol-4-amine
SMILESCC(C)Cn1cc(N)c(C2CCCC2)n1
InChIInChI=1S/C12H21N3/c1-9(2)7-15-8-11(13)12(14-15)10-5-3-4-6-10/h8-10H,3-7,13H2,1-2H3
InChIKeyNUSNMGMMYKPBEK-UHFFFAOYSA-N
XLogP2.78
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-1-(2-methylpropyl)pyrazol-4-amine?
The IUPAC name of 3-cyclopentyl-1-(2-methylpropyl)pyrazol-4-amine (CID 83216247) is 3-cyclopentyl-1-(2-methylpropyl)pyrazol-4-amine.
What is the SMILES notation for 3-cyclopentyl-1-(2-methylpropyl)pyrazol-4-amine?
The canonical SMILES for 3-cyclopentyl-1-(2-methylpropyl)pyrazol-4-amine is CC(C)Cn1cc(N)c(C2CCCC2)n1.
What is the InChIKey of 3-cyclopentyl-1-(2-methylpropyl)pyrazol-4-amine?
The InChIKey is NUSNMGMMYKPBEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3/c1-9(2)7-15-8-11(13)12(14-15)10-5-3-4-6-10/h8-10H,3-7,13H2,1-2H3.
What are the key properties of 3-cyclopentyl-1-(2-methylpropyl)pyrazol-4-amine?
3-cyclopentyl-1-(2-methylpropyl)pyrazol-4-amine has a molecular weight of 207.32 g/mol, XLogP of 2.78, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyl-1-(2-methylpropyl)pyrazol-4-amine is sourced from PubChem (CID 83216247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).