N-[3-(5-fluoro-4-methyl-3-pyridinyl)-2-oxo-1H-1,6-naphthyridin-7-yl]formamide

C15H11FN4O2 — CID 166123484

IUPACN-[3-(5-fluoro-4-methyl-3-pyridinyl)-2-oxo-1H-1,6-naphthyridin-7-yl]formamide
SMILESCc1c(F)cncc1-c1cc2cnc(NC=O)cc2[nH]c1=O
InChIInChI=1S/C15H11FN4O2/c1-8-11(5-17-6-12(8)16)10-2-9-4-18-14(19-7-21)3-13(9)20-15(10)22/h2-7H,1H3,(H,20,22)(H,18,19,21)
InChIKeySSEWCRPXFKEPQB-UHFFFAOYSA-N
MW298.28 g/mol
LogP2.00
Rot. Bonds3

About N-[3-(5-fluoro-4-methyl-3-pyridinyl)-2-oxo-1H-1,6-naphthyridin-7-yl]formamide

N-[3-(5-fluoro-4-methyl-3-pyridinyl)-2-oxo-1H-1,6-naphthyridin-7-yl]formamide (PubChem CID 166123484) has the molecular formula C15H11FN4O2 and a molecular weight of 298.28 g/mol. Its IUPAC name is N-[3-(5-fluoro-4-methyl-3-pyridinyl)-2-oxo-1H-1,6-naphthyridin-7-yl]formamide.

Molecular Properties

Compound NameN-[3-(5-fluoro-4-methyl-3-pyridinyl)-2-oxo-1H-1,6-naphthyridin-7-yl]formamide
PubChem CID166123484
Molecular FormulaC15H11FN4O2
Molecular Weight298.28 g/mol
Exact Mass298.09
IUPAC NameN-[3-(5-fluoro-4-methyl-3-pyridinyl)-2-oxo-1H-1,6-naphthyridin-7-yl]formamide
SMILESCc1c(F)cncc1-c1cc2cnc(NC=O)cc2[nH]c1=O
InChIInChI=1S/C15H11FN4O2/c1-8-11(5-17-6-12(8)16)10-2-9-4-18-14(19-7-21)3-13(9)20-15(10)22/h2-7H,1H3,(H,20,22)(H,18,19,21)
InChIKeySSEWCRPXFKEPQB-UHFFFAOYSA-N
XLogP2.00
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.28
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[3-(5-fluoro-4-methyl-3-pyridinyl)-2-oxo-1H-1,6-naphthyridin-7-yl]formamide?
The IUPAC name of N-[3-(5-fluoro-4-methyl-3-pyridinyl)-2-oxo-1H-1,6-naphthyridin-7-yl]formamide (CID 166123484) is N-[3-(5-fluoro-4-methyl-3-pyridinyl)-2-oxo-1H-1,6-naphthyridin-7-yl]formamide.
What is the SMILES notation for N-[3-(5-fluoro-4-methyl-3-pyridinyl)-2-oxo-1H-1,6-naphthyridin-7-yl]formamide?
The canonical SMILES for N-[3-(5-fluoro-4-methyl-3-pyridinyl)-2-oxo-1H-1,6-naphthyridin-7-yl]formamide is Cc1c(F)cncc1-c1cc2cnc(NC=O)cc2[nH]c1=O.
What is the InChIKey of N-[3-(5-fluoro-4-methyl-3-pyridinyl)-2-oxo-1H-1,6-naphthyridin-7-yl]formamide?
The InChIKey is SSEWCRPXFKEPQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11FN4O2/c1-8-11(5-17-6-12(8)16)10-2-9-4-18-14(19-7-21)3-13(9)20-15(10)22/h2-7H,1H3,(H,20,22)(H,18,19,21).
What are the key properties of N-[3-(5-fluoro-4-methyl-3-pyridinyl)-2-oxo-1H-1,6-naphthyridin-7-yl]formamide?
N-[3-(5-fluoro-4-methyl-3-pyridinyl)-2-oxo-1H-1,6-naphthyridin-7-yl]formamide has a molecular weight of 298.28 g/mol, XLogP of 2.00, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(5-fluoro-4-methyl-3-pyridinyl)-2-oxo-1H-1,6-naphthyridin-7-yl]formamide is sourced from PubChem (CID 166123484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).