N,7-bis[(4-fluorophenyl)methyl]-4-hydroxy-1-methyl-2-oxo-1,5-naphthyridine-3-carboxamide

C24H19F2N3O3 — CID 54752120

IUPACN,7-bis[(4-fluorophenyl)methyl]-4-hydroxy-1-methyl-2-oxo-1,5-naphthyridine-3-carboxamide
SMILESCn1c(=O)c(C(=O)NCc2ccc(F)cc2)c(O)c2ncc(Cc3ccc(F)cc3)cc21
InChIInChI=1S/C24H19F2N3O3/c1-29-19-11-16(10-14-2-6-17(25)7-3-14)13-27-21(19)22(30)20(24(29)32)23(31)28-12-15-4-8-18(26)9-5-15/h2-9,11,13,30H,10,12H2,1H3,(H,28,31)
InChIKeyZVVUFFNOQHYLCA-UHFFFAOYSA-N
MW435.43 g/mol
LogP3.44
Rot. Bonds5

About N,7-bis[(4-fluorophenyl)methyl]-4-hydroxy-1-methyl-2-oxo-1,5-naphthyridine-3-carboxamide

N,7-bis[(4-fluorophenyl)methyl]-4-hydroxy-1-methyl-2-oxo-1,5-naphthyridine-3-carboxamide (PubChem CID 54752120) has the molecular formula C24H19F2N3O3 and a molecular weight of 435.43 g/mol. Its IUPAC name is N,7-bis[(4-fluorophenyl)methyl]-4-hydroxy-1-methyl-2-oxo-1,5-naphthyridine-3-carboxamide.

Molecular Properties

Compound NameN,7-bis[(4-fluorophenyl)methyl]-4-hydroxy-1-methyl-2-oxo-1,5-naphthyridine-3-carboxamide
PubChem CID54752120
Molecular FormulaC24H19F2N3O3
Molecular Weight435.43 g/mol
Exact Mass435.14
IUPAC NameN,7-bis[(4-fluorophenyl)methyl]-4-hydroxy-1-methyl-2-oxo-1,5-naphthyridine-3-carboxamide
SMILESCn1c(=O)c(C(=O)NCc2ccc(F)cc2)c(O)c2ncc(Cc3ccc(F)cc3)cc21
InChIInChI=1S/C24H19F2N3O3/c1-29-19-11-16(10-14-2-6-17(25)7-3-14)13-27-21(19)22(30)20(24(29)32)23(31)28-12-15-4-8-18(26)9-5-15/h2-9,11,13,30H,10,12H2,1H3,(H,28,31)
InChIKeyZVVUFFNOQHYLCA-UHFFFAOYSA-N
XLogP3.44
TPSA84.22 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500435.43
LogP ≤ 53.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,7-bis[(4-fluorophenyl)methyl]-4-hydroxy-1-methyl-2-oxo-1,5-naphthyridine-3-carboxamide?
The IUPAC name of N,7-bis[(4-fluorophenyl)methyl]-4-hydroxy-1-methyl-2-oxo-1,5-naphthyridine-3-carboxamide (CID 54752120) is N,7-bis[(4-fluorophenyl)methyl]-4-hydroxy-1-methyl-2-oxo-1,5-naphthyridine-3-carboxamide.
What is the SMILES notation for N,7-bis[(4-fluorophenyl)methyl]-4-hydroxy-1-methyl-2-oxo-1,5-naphthyridine-3-carboxamide?
The canonical SMILES for N,7-bis[(4-fluorophenyl)methyl]-4-hydroxy-1-methyl-2-oxo-1,5-naphthyridine-3-carboxamide is Cn1c(=O)c(C(=O)NCc2ccc(F)cc2)c(O)c2ncc(Cc3ccc(F)cc3)cc21.
What is the InChIKey of N,7-bis[(4-fluorophenyl)methyl]-4-hydroxy-1-methyl-2-oxo-1,5-naphthyridine-3-carboxamide?
The InChIKey is ZVVUFFNOQHYLCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19F2N3O3/c1-29-19-11-16(10-14-2-6-17(25)7-3-14)13-27-21(19)22(30)20(24(29)32)23(31)28-12-15-4-8-18(26)9-5-15/h2-9,11,13,30H,10,12H2,1H3,(H,28,31).
What are the key properties of N,7-bis[(4-fluorophenyl)methyl]-4-hydroxy-1-methyl-2-oxo-1,5-naphthyridine-3-carboxamide?
N,7-bis[(4-fluorophenyl)methyl]-4-hydroxy-1-methyl-2-oxo-1,5-naphthyridine-3-carboxamide has a molecular weight of 435.43 g/mol, XLogP of 3.44, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,7-bis[(4-fluorophenyl)methyl]-4-hydroxy-1-methyl-2-oxo-1,5-naphthyridine-3-carboxamide is sourced from PubChem (CID 54752120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).