1-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]cyclopentan-1-amine

C19H19FN4 — CID 22953598

IUPAC1-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]cyclopentan-1-amine
SMILESNC1(c2[nH]nc(-c3ccc(F)cc3)c2-c2ccncc2)CCCC1
InChIInChI=1S/C19H19FN4/c20-15-5-3-14(4-6-15)17-16(13-7-11-22-12-8-13)18(24-23-17)19(21)9-1-2-10-19/h3-8,11-12H,1-2,9-10,21H2,(H,23,24)
InChIKeyDSQSNDQWAYKYRK-UHFFFAOYSA-N
MW322.39 g/mol
LogP4.01
Rot. Bonds3

About 1-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]cyclopentan-1-amine

1-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]cyclopentan-1-amine (PubChem CID 22953598) has the molecular formula C19H19FN4 and a molecular weight of 322.39 g/mol. Its IUPAC name is 1-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]cyclopentan-1-amine.

Molecular Properties

Compound Name1-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]cyclopentan-1-amine
PubChem CID22953598
Molecular FormulaC19H19FN4
Molecular Weight322.39 g/mol
Exact Mass322.16
IUPAC Name1-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]cyclopentan-1-amine
SMILESNC1(c2[nH]nc(-c3ccc(F)cc3)c2-c2ccncc2)CCCC1
InChIInChI=1S/C19H19FN4/c20-15-5-3-14(4-6-15)17-16(13-7-11-22-12-8-13)18(24-23-17)19(21)9-1-2-10-19/h3-8,11-12H,1-2,9-10,21H2,(H,23,24)
InChIKeyDSQSNDQWAYKYRK-UHFFFAOYSA-N
XLogP4.01
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.39
LogP ≤ 54.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]cyclopentan-1-amine?
The IUPAC name of 1-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]cyclopentan-1-amine (CID 22953598) is 1-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]cyclopentan-1-amine.
What is the SMILES notation for 1-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]cyclopentan-1-amine?
The canonical SMILES for 1-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]cyclopentan-1-amine is NC1(c2[nH]nc(-c3ccc(F)cc3)c2-c2ccncc2)CCCC1.
What is the InChIKey of 1-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]cyclopentan-1-amine?
The InChIKey is DSQSNDQWAYKYRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19FN4/c20-15-5-3-14(4-6-15)17-16(13-7-11-22-12-8-13)18(24-23-17)19(21)9-1-2-10-19/h3-8,11-12H,1-2,9-10,21H2,(H,23,24).
What are the key properties of 1-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]cyclopentan-1-amine?
1-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]cyclopentan-1-amine has a molecular weight of 322.39 g/mol, XLogP of 4.01, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]cyclopentan-1-amine is sourced from PubChem (CID 22953598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).