N-[(4-fluorophenyl)methyl]-8-hydroxy-6-methyl-5H-1,6-naphthyridine-7-carboxamide

C17H16FN3O2 — CID 68897850

IUPACN-[(4-fluorophenyl)methyl]-8-hydroxy-6-methyl-5H-1,6-naphthyridine-7-carboxamide
SMILESCN1Cc2cccnc2C(O)=C1C(=O)NCc1ccc(F)cc1
InChIInChI=1S/C17H16FN3O2/c1-21-10-12-3-2-8-19-14(12)16(22)15(21)17(23)20-9-11-4-6-13(18)7-5-11/h2-8,22H,9-10H2,1H3,(H,20,23)
InChIKeyYETBUVUUAFDTCG-UHFFFAOYSA-N
MW313.33 g/mol
LogP2.21
Rot. Bonds3

About N-[(4-fluorophenyl)methyl]-8-hydroxy-6-methyl-5H-1,6-naphthyridine-7-carboxamide

N-[(4-fluorophenyl)methyl]-8-hydroxy-6-methyl-5H-1,6-naphthyridine-7-carboxamide (PubChem CID 68897850) has the molecular formula C17H16FN3O2 and a molecular weight of 313.33 g/mol. Its IUPAC name is N-[(4-fluorophenyl)methyl]-8-hydroxy-6-methyl-5H-1,6-naphthyridine-7-carboxamide.

Molecular Properties

Compound NameN-[(4-fluorophenyl)methyl]-8-hydroxy-6-methyl-5H-1,6-naphthyridine-7-carboxamide
PubChem CID68897850
Molecular FormulaC17H16FN3O2
Molecular Weight313.33 g/mol
Exact Mass313.12
IUPAC NameN-[(4-fluorophenyl)methyl]-8-hydroxy-6-methyl-5H-1,6-naphthyridine-7-carboxamide
SMILESCN1Cc2cccnc2C(O)=C1C(=O)NCc1ccc(F)cc1
InChIInChI=1S/C17H16FN3O2/c1-21-10-12-3-2-8-19-14(12)16(22)15(21)17(23)20-9-11-4-6-13(18)7-5-11/h2-8,22H,9-10H2,1H3,(H,20,23)
InChIKeyYETBUVUUAFDTCG-UHFFFAOYSA-N
XLogP2.21
TPSA65.46 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.33
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(4-fluorophenyl)methyl]-8-hydroxy-6-methyl-5H-1,6-naphthyridine-7-carboxamide?
The IUPAC name of N-[(4-fluorophenyl)methyl]-8-hydroxy-6-methyl-5H-1,6-naphthyridine-7-carboxamide (CID 68897850) is N-[(4-fluorophenyl)methyl]-8-hydroxy-6-methyl-5H-1,6-naphthyridine-7-carboxamide.
What is the SMILES notation for N-[(4-fluorophenyl)methyl]-8-hydroxy-6-methyl-5H-1,6-naphthyridine-7-carboxamide?
The canonical SMILES for N-[(4-fluorophenyl)methyl]-8-hydroxy-6-methyl-5H-1,6-naphthyridine-7-carboxamide is CN1Cc2cccnc2C(O)=C1C(=O)NCc1ccc(F)cc1.
What is the InChIKey of N-[(4-fluorophenyl)methyl]-8-hydroxy-6-methyl-5H-1,6-naphthyridine-7-carboxamide?
The InChIKey is YETBUVUUAFDTCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16FN3O2/c1-21-10-12-3-2-8-19-14(12)16(22)15(21)17(23)20-9-11-4-6-13(18)7-5-11/h2-8,22H,9-10H2,1H3,(H,20,23).
What are the key properties of N-[(4-fluorophenyl)methyl]-8-hydroxy-6-methyl-5H-1,6-naphthyridine-7-carboxamide?
N-[(4-fluorophenyl)methyl]-8-hydroxy-6-methyl-5H-1,6-naphthyridine-7-carboxamide has a molecular weight of 313.33 g/mol, XLogP of 2.21, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-fluorophenyl)methyl]-8-hydroxy-6-methyl-5H-1,6-naphthyridine-7-carboxamide is sourced from PubChem (CID 68897850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).