N-[(4-fluorophenyl)methyl]-8-hydroxy-5-(2-oxoimidazolidin-1-yl)-1,6-naphthyridine-7-carboxamide

C19H16FN5O3 — CID 22346473

IUPACN-[(4-fluorophenyl)methyl]-8-hydroxy-5-(2-oxoimidazolidin-1-yl)-1,6-naphthyridine-7-carboxamide
SMILESO=C(NCc1ccc(F)cc1)c1nc(N2CCNC2=O)c2cccnc2c1O
InChIInChI=1S/C19H16FN5O3/c20-12-5-3-11(4-6-12)10-23-18(27)15-16(26)14-13(2-1-7-21-14)17(24-15)25-9-8-22-19(25)28/h1-7,26H,8-10H2,(H,22,28)(H,23,27)
InChIKeyYGJPAXRWIWOSGK-UHFFFAOYSA-N
MW381.37 g/mol
LogP1.93
Rot. Bonds4

About N-[(4-fluorophenyl)methyl]-8-hydroxy-5-(2-oxoimidazolidin-1-yl)-1,6-naphthyridine-7-carboxamide

N-[(4-fluorophenyl)methyl]-8-hydroxy-5-(2-oxoimidazolidin-1-yl)-1,6-naphthyridine-7-carboxamide (PubChem CID 22346473) has the molecular formula C19H16FN5O3 and a molecular weight of 381.37 g/mol. Its IUPAC name is N-[(4-fluorophenyl)methyl]-8-hydroxy-5-(2-oxoimidazolidin-1-yl)-1,6-naphthyridine-7-carboxamide.

Molecular Properties

Compound NameN-[(4-fluorophenyl)methyl]-8-hydroxy-5-(2-oxoimidazolidin-1-yl)-1,6-naphthyridine-7-carboxamide
PubChem CID22346473
Molecular FormulaC19H16FN5O3
Molecular Weight381.37 g/mol
Exact Mass381.12
IUPAC NameN-[(4-fluorophenyl)methyl]-8-hydroxy-5-(2-oxoimidazolidin-1-yl)-1,6-naphthyridine-7-carboxamide
SMILESO=C(NCc1ccc(F)cc1)c1nc(N2CCNC2=O)c2cccnc2c1O
InChIInChI=1S/C19H16FN5O3/c20-12-5-3-11(4-6-12)10-23-18(27)15-16(26)14-13(2-1-7-21-14)17(24-15)25-9-8-22-19(25)28/h1-7,26H,8-10H2,(H,22,28)(H,23,27)
InChIKeyYGJPAXRWIWOSGK-UHFFFAOYSA-N
XLogP1.93
TPSA107.45 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.37
LogP ≤ 51.93
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[(4-fluorophenyl)methyl]-8-hydroxy-5-(2-oxoimidazolidin-1-yl)-1,6-naphthyridine-7-carboxamide?
The IUPAC name of N-[(4-fluorophenyl)methyl]-8-hydroxy-5-(2-oxoimidazolidin-1-yl)-1,6-naphthyridine-7-carboxamide (CID 22346473) is N-[(4-fluorophenyl)methyl]-8-hydroxy-5-(2-oxoimidazolidin-1-yl)-1,6-naphthyridine-7-carboxamide.
What is the SMILES notation for N-[(4-fluorophenyl)methyl]-8-hydroxy-5-(2-oxoimidazolidin-1-yl)-1,6-naphthyridine-7-carboxamide?
The canonical SMILES for N-[(4-fluorophenyl)methyl]-8-hydroxy-5-(2-oxoimidazolidin-1-yl)-1,6-naphthyridine-7-carboxamide is O=C(NCc1ccc(F)cc1)c1nc(N2CCNC2=O)c2cccnc2c1O.
What is the InChIKey of N-[(4-fluorophenyl)methyl]-8-hydroxy-5-(2-oxoimidazolidin-1-yl)-1,6-naphthyridine-7-carboxamide?
The InChIKey is YGJPAXRWIWOSGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16FN5O3/c20-12-5-3-11(4-6-12)10-23-18(27)15-16(26)14-13(2-1-7-21-14)17(24-15)25-9-8-22-19(25)28/h1-7,26H,8-10H2,(H,22,28)(H,23,27).
What are the key properties of N-[(4-fluorophenyl)methyl]-8-hydroxy-5-(2-oxoimidazolidin-1-yl)-1,6-naphthyridine-7-carboxamide?
N-[(4-fluorophenyl)methyl]-8-hydroxy-5-(2-oxoimidazolidin-1-yl)-1,6-naphthyridine-7-carboxamide has a molecular weight of 381.37 g/mol, XLogP of 1.93, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-fluorophenyl)methyl]-8-hydroxy-5-(2-oxoimidazolidin-1-yl)-1,6-naphthyridine-7-carboxamide is sourced from PubChem (CID 22346473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).