5-(3-cyclopentylphenyl)-1H-pyrazol-3-amine

C14H17N3 — CID 117327434

IUPAC5-(3-cyclopentylphenyl)-1H-pyrazol-3-amine
SMILESNc1cc(-c2cccc(C3CCCC3)c2)[nH]n1
InChIInChI=1S/C14H17N3/c15-14-9-13(16-17-14)12-7-3-6-11(8-12)10-4-1-2-5-10/h3,6-10H,1-2,4-5H2,(H3,15,16,17)
InChIKeyBUFWXVSZYFBSFK-UHFFFAOYSA-N
MW227.31 g/mol
LogP3.32
Rot. Bonds2

About 5-(3-cyclopentylphenyl)-1H-pyrazol-3-amine

5-(3-cyclopentylphenyl)-1H-pyrazol-3-amine (PubChem CID 117327434) has the molecular formula C14H17N3 and a molecular weight of 227.31 g/mol. Its IUPAC name is 5-(3-cyclopentylphenyl)-1H-pyrazol-3-amine.

Molecular Properties

Compound Name5-(3-cyclopentylphenyl)-1H-pyrazol-3-amine
PubChem CID117327434
Molecular FormulaC14H17N3
Molecular Weight227.31 g/mol
Exact Mass227.14
IUPAC Name5-(3-cyclopentylphenyl)-1H-pyrazol-3-amine
SMILESNc1cc(-c2cccc(C3CCCC3)c2)[nH]n1
InChIInChI=1S/C14H17N3/c15-14-9-13(16-17-14)12-7-3-6-11(8-12)10-4-1-2-5-10/h3,6-10H,1-2,4-5H2,(H3,15,16,17)
InChIKeyBUFWXVSZYFBSFK-UHFFFAOYSA-N
XLogP3.32
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 53.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-(3-cyclopentylphenyl)-1H-pyrazol-3-amine?
The IUPAC name of 5-(3-cyclopentylphenyl)-1H-pyrazol-3-amine (CID 117327434) is 5-(3-cyclopentylphenyl)-1H-pyrazol-3-amine.
What is the SMILES notation for 5-(3-cyclopentylphenyl)-1H-pyrazol-3-amine?
The canonical SMILES for 5-(3-cyclopentylphenyl)-1H-pyrazol-3-amine is Nc1cc(-c2cccc(C3CCCC3)c2)[nH]n1.
What is the InChIKey of 5-(3-cyclopentylphenyl)-1H-pyrazol-3-amine?
The InChIKey is BUFWXVSZYFBSFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3/c15-14-9-13(16-17-14)12-7-3-6-11(8-12)10-4-1-2-5-10/h3,6-10H,1-2,4-5H2,(H3,15,16,17).
What are the key properties of 5-(3-cyclopentylphenyl)-1H-pyrazol-3-amine?
5-(3-cyclopentylphenyl)-1H-pyrazol-3-amine has a molecular weight of 227.31 g/mol, XLogP of 3.32, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-cyclopentylphenyl)-1H-pyrazol-3-amine is sourced from PubChem (CID 117327434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).