3-cyclopentyl-1-phenylpyrazol-4-amine

C14H17N3 — CID 83217224

IUPAC3-cyclopentyl-1-phenylpyrazol-4-amine
SMILESNc1cn(-c2ccccc2)nc1C1CCCC1
InChIInChI=1S/C14H17N3/c15-13-10-17(12-8-2-1-3-9-12)16-14(13)11-6-4-5-7-11/h1-3,8-11H,4-7,15H2
InChIKeyOPKLEKHRGWOIAR-UHFFFAOYSA-N
MW227.31 g/mol
LogP3.11
Rot. Bonds2

About 3-cyclopentyl-1-phenylpyrazol-4-amine

3-cyclopentyl-1-phenylpyrazol-4-amine (PubChem CID 83217224) has the molecular formula C14H17N3 and a molecular weight of 227.31 g/mol. Its IUPAC name is 3-cyclopentyl-1-phenylpyrazol-4-amine.

Molecular Properties

Compound Name3-cyclopentyl-1-phenylpyrazol-4-amine
PubChem CID83217224
Molecular FormulaC14H17N3
Molecular Weight227.31 g/mol
Exact Mass227.14
IUPAC Name3-cyclopentyl-1-phenylpyrazol-4-amine
SMILESNc1cn(-c2ccccc2)nc1C1CCCC1
InChIInChI=1S/C14H17N3/c15-13-10-17(12-8-2-1-3-9-12)16-14(13)11-6-4-5-7-11/h1-3,8-11H,4-7,15H2
InChIKeyOPKLEKHRGWOIAR-UHFFFAOYSA-N
XLogP3.11
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-1-phenylpyrazol-4-amine?
The IUPAC name of 3-cyclopentyl-1-phenylpyrazol-4-amine (CID 83217224) is 3-cyclopentyl-1-phenylpyrazol-4-amine.
What is the SMILES notation for 3-cyclopentyl-1-phenylpyrazol-4-amine?
The canonical SMILES for 3-cyclopentyl-1-phenylpyrazol-4-amine is Nc1cn(-c2ccccc2)nc1C1CCCC1.
What is the InChIKey of 3-cyclopentyl-1-phenylpyrazol-4-amine?
The InChIKey is OPKLEKHRGWOIAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3/c15-13-10-17(12-8-2-1-3-9-12)16-14(13)11-6-4-5-7-11/h1-3,8-11H,4-7,15H2.
What are the key properties of 3-cyclopentyl-1-phenylpyrazol-4-amine?
3-cyclopentyl-1-phenylpyrazol-4-amine has a molecular weight of 227.31 g/mol, XLogP of 3.11, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyl-1-phenylpyrazol-4-amine is sourced from PubChem (CID 83217224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).