1-[4-(4-fluorophenyl)-2-pyrazol-1-ylcyclopentyl]piperidin-3-amine

C19H25FN4 — CID 146240925

IUPAC1-[4-(4-fluorophenyl)-2-pyrazol-1-ylcyclopentyl]piperidin-3-amine
SMILESNC1CCCN(C2CC(c3ccc(F)cc3)CC2n2cccn2)C1
InChIInChI=1S/C19H25FN4/c20-16-6-4-14(5-7-16)15-11-18(23-9-1-3-17(21)13-23)19(12-15)24-10-2-8-22-24/h2,4-8,10,15,17-19H,1,3,9,11-13,21H2
InChIKeyMZAOLBDFKVMZHQ-UHFFFAOYSA-N
MW328.44 g/mol
LogP2.93
Rot. Bonds3

About 1-[4-(4-fluorophenyl)-2-pyrazol-1-ylcyclopentyl]piperidin-3-amine

1-[4-(4-fluorophenyl)-2-pyrazol-1-ylcyclopentyl]piperidin-3-amine (PubChem CID 146240925) has the molecular formula C19H25FN4 and a molecular weight of 328.44 g/mol. Its IUPAC name is 1-[4-(4-fluorophenyl)-2-pyrazol-1-ylcyclopentyl]piperidin-3-amine.

Molecular Properties

Compound Name1-[4-(4-fluorophenyl)-2-pyrazol-1-ylcyclopentyl]piperidin-3-amine
PubChem CID146240925
Molecular FormulaC19H25FN4
Molecular Weight328.44 g/mol
Exact Mass328.21
IUPAC Name1-[4-(4-fluorophenyl)-2-pyrazol-1-ylcyclopentyl]piperidin-3-amine
SMILESNC1CCCN(C2CC(c3ccc(F)cc3)CC2n2cccn2)C1
InChIInChI=1S/C19H25FN4/c20-16-6-4-14(5-7-16)15-11-18(23-9-1-3-17(21)13-23)19(12-15)24-10-2-8-22-24/h2,4-8,10,15,17-19H,1,3,9,11-13,21H2
InChIKeyMZAOLBDFKVMZHQ-UHFFFAOYSA-N
XLogP2.93
TPSA47.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.44
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-[(2-Fluorophenyl)methyl]-1-[2-(3-methylpyrazol-1-yl)ethyl]piperidine
CID 28357663
3-[2-(2,4-difluorophenyl)ethyl]-1-[(1-methyl-1H-pyrazol-4-yl)methyl]piperidine
CID 45227951
1,2-dimethyl-4-[2-(1H-pyrazol-1-ylmethyl)benzyl]piperazine
CID 50962406
3-(2-fluorophenyl)-5-(1-methylpyrazol-4-yl)-2,3,3a,4,5,6,7,7a-octahydro-1H-pyrazolo[3,4-c]pyridine
CID 78054697
US11274091, Example 6
CID 146240775
US11274091, Example 3
CID 146240801
US11274091, Example 2
CID 146240969
US11274091, Example 7
CID 146240975
US11274091, Example 9
CID 149453304
4-(4-phenyl-1H-pyrazol-1-yl)piperidine
CID 24208827
3-[2-(4-fluorophenyl)ethyl]-1-[(1-methyl-1H-pyrazol-4-yl)methyl]piperidine
CID 56865788
2-phenyl-2-(1H-pyrazol-1-yl)ethan-1-amine
CID 45792667

Frequently Asked Questions

What is the IUPAC name of 1-[4-(4-fluorophenyl)-2-pyrazol-1-ylcyclopentyl]piperidin-3-amine?
The IUPAC name of 1-[4-(4-fluorophenyl)-2-pyrazol-1-ylcyclopentyl]piperidin-3-amine (CID 146240925) is 1-[4-(4-fluorophenyl)-2-pyrazol-1-ylcyclopentyl]piperidin-3-amine.
What is the SMILES notation for 1-[4-(4-fluorophenyl)-2-pyrazol-1-ylcyclopentyl]piperidin-3-amine?
The canonical SMILES for 1-[4-(4-fluorophenyl)-2-pyrazol-1-ylcyclopentyl]piperidin-3-amine is NC1CCCN(C2CC(c3ccc(F)cc3)CC2n2cccn2)C1.
What is the InChIKey of 1-[4-(4-fluorophenyl)-2-pyrazol-1-ylcyclopentyl]piperidin-3-amine?
The InChIKey is MZAOLBDFKVMZHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25FN4/c20-16-6-4-14(5-7-16)15-11-18(23-9-1-3-17(21)13-23)19(12-15)24-10-2-8-22-24/h2,4-8,10,15,17-19H,1,3,9,11-13,21H2.
What are the key properties of 1-[4-(4-fluorophenyl)-2-pyrazol-1-ylcyclopentyl]piperidin-3-amine?
1-[4-(4-fluorophenyl)-2-pyrazol-1-ylcyclopentyl]piperidin-3-amine has a molecular weight of 328.44 g/mol, XLogP of 2.93, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(4-fluorophenyl)-2-pyrazol-1-ylcyclopentyl]piperidin-3-amine is sourced from PubChem (CID 146240925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).