4-fluoro-N-[5-(3-methoxyanilino)-2-pyridinyl]-1H-pyrazole-5-carboxamide

Name: 4-fluoro-N-[5-(3-methoxyanilino)-2-pyridinyl]-1H-pyrazole-5-carboxamide — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₁₆H₁₄FN₅O₂ — CID 154793582

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPAC4-fluoro-N-[5-(3-methoxyanilino)-2-pyridinyl]-1H-pyrazole-5-carboxamide

SMILESCOc1cccc(Nc2ccc(NC(=O)c3[nH]ncc3F)nc2)c1

InChIInChI=1S/C16H14FN5O2/c1-24-12-4-2-3-10(7-12)20-11-5-6-14(18-8-11)21-16(23)15-13(17)9-19-22-15/h2-9,20H,1H3,(H,19,22)(H,18,21,23)

InChIKeyXRXAWRRDOIXQEM-UHFFFAOYSA-N

MW327.32 g/mol

LogP2.95

Rot. Bonds5

About 4-fluoro-N-[5-(3-methoxyanilino)-2-pyridinyl]-1H-pyrazole-5-carboxamide

4-fluoro-N-[5-(3-methoxyanilino)-2-pyridinyl]-1H-pyrazole-5-carboxamide (PubChem CID 154793582) has the molecular formula C₁₆H₁₄FN₅O₂ and a molecular weight of 327.32 g/mol. Its IUPAC name is 4-fluoro-N-[5-(3-methoxyanilino)-2-pyridinyl]-1H-pyrazole-5-carboxamide.

Molecular Properties

Compound Name	4-fluoro-N-[5-(3-methoxyanilino)-2-pyridinyl]-1H-pyrazole-5-carboxamide
PubChem CID	154793582
Molecular Formula	C₁₆H₁₄FN₅O₂
Molecular Weight	327.32 g/mol
Exact Mass	327.11
IUPAC Name	4-fluoro-N-[5-(3-methoxyanilino)-2-pyridinyl]-1H-pyrazole-5-carboxamide
SMILES	COc1cccc(Nc2ccc(NC(=O)c3[nH]ncc3F)nc2)c1
InChI	InChI=1S/C16H14FN5O2/c1-24-12-4-2-3-10(7-12)20-11-5-6-14(18-8-11)21-16(23)15-13(17)9-19-22-15/h2-9,20H,1H3,(H,19,22)(H,18,21,23)
InChIKey	XRXAWRRDOIXQEM-UHFFFAOYSA-N
XLogP	2.95
TPSA	91.93 Å²
H-Bond Donors	3
H-Bond Acceptors	5
Rotatable Bonds	5
Heavy Atoms	24
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	327.32
LogP ≤ 5	2.95
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-[5-(3-methoxyanilino)-2-pyridinyl]-1H-pyrazole-5-carboxamide?

The IUPAC name of 4-fluoro-N-[5-(3-methoxyanilino)-2-pyridinyl]-1H-pyrazole-5-carboxamide (CID 154793582) is 4-fluoro-N-[5-(3-methoxyanilino)-2-pyridinyl]-1H-pyrazole-5-carboxamide.

What is the SMILES notation for 4-fluoro-N-[5-(3-methoxyanilino)-2-pyridinyl]-1H-pyrazole-5-carboxamide?

The canonical SMILES for 4-fluoro-N-[5-(3-methoxyanilino)-2-pyridinyl]-1H-pyrazole-5-carboxamide is COc1cccc(Nc2ccc(NC(=O)c3[nH]ncc3F)nc2)c1.

What is the InChIKey of 4-fluoro-N-[5-(3-methoxyanilino)-2-pyridinyl]-1H-pyrazole-5-carboxamide?

The InChIKey is XRXAWRRDOIXQEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14FN5O2/c1-24-12-4-2-3-10(7-12)20-11-5-6-14(18-8-11)21-16(23)15-13(17)9-19-22-15/h2-9,20H,1H3,(H,19,22)(H,18,21,23).

What are the key properties of 4-fluoro-N-[5-(3-methoxyanilino)-2-pyridinyl]-1H-pyrazole-5-carboxamide?

4-fluoro-N-[5-(3-methoxyanilino)-2-pyridinyl]-1H-pyrazole-5-carboxamide has a molecular weight of 327.32 g/mol, XLogP of 2.95, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 4-fluoro-N-[5-(3-methoxyanilino)-2-pyridinyl]-1H-pyrazole-5-carboxamide is sourced from PubChem (CID 154793582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 154793582 — identifiers, structure, computed properties (public domain)

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