1-[2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl]pyrazol-3-amine

C15H20FN5 — CID 63318148

IUPAC1-[2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl]pyrazol-3-amine
SMILESNc1ccn(CCN2CCN(c3ccc(F)cc3)CC2)n1
InChIInChI=1S/C15H20FN5/c16-13-1-3-14(4-2-13)20-10-7-19(8-11-20)9-12-21-6-5-15(17)18-21/h1-6H,7-12H2,(H2,17,18)
InChIKeyIUJQCJDVMBAIRV-UHFFFAOYSA-N
MW289.36 g/mol
LogP1.43
Rot. Bonds4

About 1-[2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl]pyrazol-3-amine

1-[2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl]pyrazol-3-amine (PubChem CID 63318148) has the molecular formula C15H20FN5 and a molecular weight of 289.36 g/mol. Its IUPAC name is 1-[2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl]pyrazol-3-amine.

Molecular Properties

Compound Name1-[2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl]pyrazol-3-amine
PubChem CID63318148
Molecular FormulaC15H20FN5
Molecular Weight289.36 g/mol
Exact Mass289.17
IUPAC Name1-[2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl]pyrazol-3-amine
SMILESNc1ccn(CCN2CCN(c3ccc(F)cc3)CC2)n1
InChIInChI=1S/C15H20FN5/c16-13-1-3-14(4-2-13)20-10-7-19(8-11-20)9-12-21-6-5-15(17)18-21/h1-6H,7-12H2,(H2,17,18)
InChIKeyIUJQCJDVMBAIRV-UHFFFAOYSA-N
XLogP1.43
TPSA50.32 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.36
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(4-fluorophenyl)-4-[2-[3-(trifluoromethyl)pyrazol-1-yl]ethyl]piperazine
CID 154541150
1-(4-fluorophenyl)-4-[2-(1,2,4-triazol-1-yl)ethyl]piperazine
CID 51108536
1-(4-fluorophenyl)-4-[2-(triazol-1-yl)ethyl]piperazine;hydrochloride
CID 142648014
1-[2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl]piperidin-4-ol
CID 28957837
1-[2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]ethyl]pyrazol-3-amine
CID 63318325
1-benzyl-4-[2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl]piperazine
CID 171911015
1-[2-(8-azaspiro[4.5]decan-8-yl)ethyl]pyrazol-3-amine
CID 63315886
1-[2-(4-fluorophenyl)sulfanylethyl]pyrazol-3-amine
CID 63315951
2-[2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl]aniline
CID 13217691
5-[2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl]-1,3,4-thiadiazol-2-amine
CID 82058182
1-(4-fluorophenyl)-4-[2-(4-phenyltriazol-1-yl)ethyl]piperazine;hydrochloride
CID 142709660
2-[2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl]-5,6,7,8-tetrahydrocinnolin-3-one
CID 139680137

Frequently Asked Questions

What is the IUPAC name of 1-[2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl]pyrazol-3-amine?
The IUPAC name of 1-[2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl]pyrazol-3-amine (CID 63318148) is 1-[2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl]pyrazol-3-amine.
What is the SMILES notation for 1-[2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl]pyrazol-3-amine?
The canonical SMILES for 1-[2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl]pyrazol-3-amine is Nc1ccn(CCN2CCN(c3ccc(F)cc3)CC2)n1.
What is the InChIKey of 1-[2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl]pyrazol-3-amine?
The InChIKey is IUJQCJDVMBAIRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20FN5/c16-13-1-3-14(4-2-13)20-10-7-19(8-11-20)9-12-21-6-5-15(17)18-21/h1-6H,7-12H2,(H2,17,18).
What are the key properties of 1-[2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl]pyrazol-3-amine?
1-[2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl]pyrazol-3-amine has a molecular weight of 289.36 g/mol, XLogP of 1.43, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl]pyrazol-3-amine is sourced from PubChem (CID 63318148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).