4-[3-(5-fluoro-2-pyridinyl)-1-methylpyrazol-4-yl]-1,5-naphthyridine

C17H12FN5 — CID 162760838

IUPAC4-[3-(5-fluoro-2-pyridinyl)-1-methylpyrazol-4-yl]-1,5-naphthyridine
SMILESCn1cc(-c2ccnc3cccnc23)c(-c2ccc(F)cn2)n1
InChIInChI=1S/C17H12FN5/c1-23-10-13(17(22-23)15-5-4-11(18)9-21-15)12-6-8-19-14-3-2-7-20-16(12)14/h2-10H,1H3
InChIKeyCNNCZJNVIGTDMR-UHFFFAOYSA-N
MW305.32 g/mol
LogP3.23
Rot. Bonds2

About 4-[3-(5-fluoro-2-pyridinyl)-1-methylpyrazol-4-yl]-1,5-naphthyridine

4-[3-(5-fluoro-2-pyridinyl)-1-methylpyrazol-4-yl]-1,5-naphthyridine (PubChem CID 162760838) has the molecular formula C17H12FN5 and a molecular weight of 305.32 g/mol. Its IUPAC name is 4-[3-(5-fluoro-2-pyridinyl)-1-methylpyrazol-4-yl]-1,5-naphthyridine.

Molecular Properties

Compound Name4-[3-(5-fluoro-2-pyridinyl)-1-methylpyrazol-4-yl]-1,5-naphthyridine
PubChem CID162760838
Molecular FormulaC17H12FN5
Molecular Weight305.32 g/mol
Exact Mass305.11
IUPAC Name4-[3-(5-fluoro-2-pyridinyl)-1-methylpyrazol-4-yl]-1,5-naphthyridine
SMILESCn1cc(-c2ccnc3cccnc23)c(-c2ccc(F)cn2)n1
InChIInChI=1S/C17H12FN5/c1-23-10-13(17(22-23)15-5-4-11(18)9-21-15)12-6-8-19-14-3-2-7-20-16(12)14/h2-10H,1H3
InChIKeyCNNCZJNVIGTDMR-UHFFFAOYSA-N
XLogP3.23
TPSA56.49 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.32
LogP ≤ 53.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[3-(5-fluoro-2-pyridinyl)-1-methylpyrazol-4-yl]-1,5-naphthyridine?
The IUPAC name of 4-[3-(5-fluoro-2-pyridinyl)-1-methylpyrazol-4-yl]-1,5-naphthyridine (CID 162760838) is 4-[3-(5-fluoro-2-pyridinyl)-1-methylpyrazol-4-yl]-1,5-naphthyridine.
What is the SMILES notation for 4-[3-(5-fluoro-2-pyridinyl)-1-methylpyrazol-4-yl]-1,5-naphthyridine?
The canonical SMILES for 4-[3-(5-fluoro-2-pyridinyl)-1-methylpyrazol-4-yl]-1,5-naphthyridine is Cn1cc(-c2ccnc3cccnc23)c(-c2ccc(F)cn2)n1.
What is the InChIKey of 4-[3-(5-fluoro-2-pyridinyl)-1-methylpyrazol-4-yl]-1,5-naphthyridine?
The InChIKey is CNNCZJNVIGTDMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12FN5/c1-23-10-13(17(22-23)15-5-4-11(18)9-21-15)12-6-8-19-14-3-2-7-20-16(12)14/h2-10H,1H3.
What are the key properties of 4-[3-(5-fluoro-2-pyridinyl)-1-methylpyrazol-4-yl]-1,5-naphthyridine?
4-[3-(5-fluoro-2-pyridinyl)-1-methylpyrazol-4-yl]-1,5-naphthyridine has a molecular weight of 305.32 g/mol, XLogP of 3.23, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(5-fluoro-2-pyridinyl)-1-methylpyrazol-4-yl]-1,5-naphthyridine is sourced from PubChem (CID 162760838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).