1-(4-fluorophenyl)-N-isoquinolin-1-yl-4-oxo-1,8-naphthyridine-3-carboxamide

C24H15FN4O2 — CID 70011896

IUPAC1-(4-fluorophenyl)-N-isoquinolin-1-yl-4-oxo-1,8-naphthyridine-3-carboxamide
SMILESO=C(Nc1nccc2ccccc12)c1cn(-c2ccc(F)cc2)c2ncccc2c1=O
InChIInChI=1S/C24H15FN4O2/c25-16-7-9-17(10-8-16)29-14-20(21(30)19-6-3-12-27-23(19)29)24(31)28-22-18-5-2-1-4-15(18)11-13-26-22/h1-14H,(H,26,28,31)
InChIKeyCYOAZHPWEYBTPE-UHFFFAOYSA-N
MW410.41 g/mol
LogP4.33
Rot. Bonds3

About 1-(4-fluorophenyl)-N-isoquinolin-1-yl-4-oxo-1,8-naphthyridine-3-carboxamide

1-(4-fluorophenyl)-N-isoquinolin-1-yl-4-oxo-1,8-naphthyridine-3-carboxamide (PubChem CID 70011896) has the molecular formula C24H15FN4O2 and a molecular weight of 410.41 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-N-isoquinolin-1-yl-4-oxo-1,8-naphthyridine-3-carboxamide.

Molecular Properties

Compound Name1-(4-fluorophenyl)-N-isoquinolin-1-yl-4-oxo-1,8-naphthyridine-3-carboxamide
PubChem CID70011896
Molecular FormulaC24H15FN4O2
Molecular Weight410.41 g/mol
Exact Mass410.12
IUPAC Name1-(4-fluorophenyl)-N-isoquinolin-1-yl-4-oxo-1,8-naphthyridine-3-carboxamide
SMILESO=C(Nc1nccc2ccccc12)c1cn(-c2ccc(F)cc2)c2ncccc2c1=O
InChIInChI=1S/C24H15FN4O2/c25-16-7-9-17(10-8-16)29-14-20(21(30)19-6-3-12-27-23(19)29)24(31)28-22-18-5-2-1-4-15(18)11-13-26-22/h1-14H,(H,26,28,31)
InChIKeyCYOAZHPWEYBTPE-UHFFFAOYSA-N
XLogP4.33
TPSA76.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.41
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(4-fluorophenyl)-4-oxo-N-quinolin-2-yl-1,8-naphthyridine-3-carboxamide
CID 70012237
1-(4-fluorophenyl)-4-oxo-N-pyridin-4-yl-1,8-naphthyridine-3-carboxamide
CID 70012505
N-(4-carbamoylphenyl)-1-(4-fluorophenyl)-4-oxo-1,8-naphthyridine-3-carboxamide
CID 70011012
1-(4-fluorophenyl)-4-oxo-N-propan-2-yl-1,8-naphthyridine-3-carboxamide
CID 70011978
1-(4-fluorophenyl)-4-oxo-N-(pyridin-3-ylmethyl)-1,8-naphthyridine-3-carboxamide
CID 70011453
1-(4-methylphenyl)-4-oxo-N-pyridin-4-yl-1,8-naphthyridine-3-carboxamide
CID 70012845
N-isoquinolin-1-yl-2-methoxybenzamide
CID 53439282
1-ethyl-6-fluoro-N-(3-methyl-2-pyridinyl)-4-oxoquinoline-3-carboxamide
CID 39851051
1-(4-fluorophenyl)pyrido[2,3-d]pyrimidin-4-one
CID 901921
N-[3-fluoro-4-[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinolin-4-yl]oxyphenyl]-1-(4-fluorophenyl)-4-oxo-1,8-naphthyridine-3-carboxamide
CID 155679200
1-(4-bromophenyl)-4-oxo-N-[4-(7H-pyrrolo[2,3-d]pyrimidin-4-yloxy)phenyl]-1,8-naphthyridine-3-carboxamide
CID 155679209
1-[(4-fluorophenyl)methyl]-N-(3-methyl-2-pyridinyl)-2-oxo-1,8-naphthyridine-3-carboxamide
CID 7620827

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-N-isoquinolin-1-yl-4-oxo-1,8-naphthyridine-3-carboxamide?
The IUPAC name of 1-(4-fluorophenyl)-N-isoquinolin-1-yl-4-oxo-1,8-naphthyridine-3-carboxamide (CID 70011896) is 1-(4-fluorophenyl)-N-isoquinolin-1-yl-4-oxo-1,8-naphthyridine-3-carboxamide.
What is the SMILES notation for 1-(4-fluorophenyl)-N-isoquinolin-1-yl-4-oxo-1,8-naphthyridine-3-carboxamide?
The canonical SMILES for 1-(4-fluorophenyl)-N-isoquinolin-1-yl-4-oxo-1,8-naphthyridine-3-carboxamide is O=C(Nc1nccc2ccccc12)c1cn(-c2ccc(F)cc2)c2ncccc2c1=O.
What is the InChIKey of 1-(4-fluorophenyl)-N-isoquinolin-1-yl-4-oxo-1,8-naphthyridine-3-carboxamide?
The InChIKey is CYOAZHPWEYBTPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H15FN4O2/c25-16-7-9-17(10-8-16)29-14-20(21(30)19-6-3-12-27-23(19)29)24(31)28-22-18-5-2-1-4-15(18)11-13-26-22/h1-14H,(H,26,28,31).
What are the key properties of 1-(4-fluorophenyl)-N-isoquinolin-1-yl-4-oxo-1,8-naphthyridine-3-carboxamide?
1-(4-fluorophenyl)-N-isoquinolin-1-yl-4-oxo-1,8-naphthyridine-3-carboxamide has a molecular weight of 410.41 g/mol, XLogP of 4.33, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-N-isoquinolin-1-yl-4-oxo-1,8-naphthyridine-3-carboxamide is sourced from PubChem (CID 70011896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).