3-fluoropyridine;N-[1-(5-fluoro-3-pyridinyl)pyrazol-3-yl]spiro[2.2]pentane-2-carboxamide

C19H17F2N5O — CID 142372129

IUPAC3-fluoropyridine;N-[1-(5-fluoro-3-pyridinyl)pyrazol-3-yl]spiro[2.2]pentane-2-carboxamide
SMILESFc1cccnc1.O=C(Nc1ccn(-c2cncc(F)c2)n1)C1CC12CC2
InChIInChI=1S/C14H13FN4O.C5H4FN/c15-9-5-10(8-16-7-9)19-4-1-12(18-19)17-13(20)11-6-14(11)2-3-14;6-5-2-1-3-7-4-5/h1,4-5,7-8,11H,2-3,6H2,(H,17,18,20);1-4H
InChIKeyFKGLIYRANFEZJU-UHFFFAOYSA-N
MW369.38 g/mol
LogP3.37
Rot. Bonds3

About 3-fluoropyridine;N-[1-(5-fluoro-3-pyridinyl)pyrazol-3-yl]spiro[2.2]pentane-2-carboxamide

3-fluoropyridine;N-[1-(5-fluoro-3-pyridinyl)pyrazol-3-yl]spiro[2.2]pentane-2-carboxamide (PubChem CID 142372129) has the molecular formula C19H17F2N5O and a molecular weight of 369.38 g/mol. Its IUPAC name is 3-fluoropyridine;N-[1-(5-fluoro-3-pyridinyl)pyrazol-3-yl]spiro[2.2]pentane-2-carboxamide.

Molecular Properties

Compound Name3-fluoropyridine;N-[1-(5-fluoro-3-pyridinyl)pyrazol-3-yl]spiro[2.2]pentane-2-carboxamide
PubChem CID142372129
Molecular FormulaC19H17F2N5O
Molecular Weight369.38 g/mol
Exact Mass369.14
IUPAC Name3-fluoropyridine;N-[1-(5-fluoro-3-pyridinyl)pyrazol-3-yl]spiro[2.2]pentane-2-carboxamide
SMILESFc1cccnc1.O=C(Nc1ccn(-c2cncc(F)c2)n1)C1CC12CC2
InChIInChI=1S/C14H13FN4O.C5H4FN/c15-9-5-10(8-16-7-9)19-4-1-12(18-19)17-13(20)11-6-14(11)2-3-14;6-5-2-1-3-7-4-5/h1,4-5,7-8,11H,2-3,6H2,(H,17,18,20);1-4H
InChIKeyFKGLIYRANFEZJU-UHFFFAOYSA-N
XLogP3.37
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.38
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-fluoropyridine;N-[1-(5-fluoro-3-pyridinyl)pyrazol-3-yl]spiro[2.2]pentane-2-carboxamide?
The IUPAC name of 3-fluoropyridine;N-[1-(5-fluoro-3-pyridinyl)pyrazol-3-yl]spiro[2.2]pentane-2-carboxamide (CID 142372129) is 3-fluoropyridine;N-[1-(5-fluoro-3-pyridinyl)pyrazol-3-yl]spiro[2.2]pentane-2-carboxamide.
What is the SMILES notation for 3-fluoropyridine;N-[1-(5-fluoro-3-pyridinyl)pyrazol-3-yl]spiro[2.2]pentane-2-carboxamide?
The canonical SMILES for 3-fluoropyridine;N-[1-(5-fluoro-3-pyridinyl)pyrazol-3-yl]spiro[2.2]pentane-2-carboxamide is Fc1cccnc1.O=C(Nc1ccn(-c2cncc(F)c2)n1)C1CC12CC2.
What is the InChIKey of 3-fluoropyridine;N-[1-(5-fluoro-3-pyridinyl)pyrazol-3-yl]spiro[2.2]pentane-2-carboxamide?
The InChIKey is FKGLIYRANFEZJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13FN4O.C5H4FN/c15-9-5-10(8-16-7-9)19-4-1-12(18-19)17-13(20)11-6-14(11)2-3-14;6-5-2-1-3-7-4-5/h1,4-5,7-8,11H,2-3,6H2,(H,17,18,20);1-4H.
What are the key properties of 3-fluoropyridine;N-[1-(5-fluoro-3-pyridinyl)pyrazol-3-yl]spiro[2.2]pentane-2-carboxamide?
3-fluoropyridine;N-[1-(5-fluoro-3-pyridinyl)pyrazol-3-yl]spiro[2.2]pentane-2-carboxamide has a molecular weight of 369.38 g/mol, XLogP of 3.37, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoropyridine;N-[1-(5-fluoro-3-pyridinyl)pyrazol-3-yl]spiro[2.2]pentane-2-carboxamide is sourced from PubChem (CID 142372129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).