5-hydroxy-3-phenyl-1-(2-phenylethyl)-8-pyridin-3-yl-1,7-naphthyridin-2-one

C27H21N3O2 — CID 141351889

IUPAC5-hydroxy-3-phenyl-1-(2-phenylethyl)-8-pyridin-3-yl-1,7-naphthyridin-2-one
SMILESO=c1c(-c2ccccc2)cc2c(O)cnc(-c3cccnc3)c2n1CCc1ccccc1
InChIInChI=1S/C27H21N3O2/c31-24-18-29-25(21-12-7-14-28-17-21)26-23(24)16-22(20-10-5-2-6-11-20)27(32)30(26)15-13-19-8-3-1-4-9-19/h1-12,14,16-18,31H,13,15H2
InChIKeyCJVYJZFAGPLBFT-UHFFFAOYSA-N
MW419.48 g/mol
LogP5.07
Rot. Bonds5

About 5-hydroxy-3-phenyl-1-(2-phenylethyl)-8-pyridin-3-yl-1,7-naphthyridin-2-one

5-hydroxy-3-phenyl-1-(2-phenylethyl)-8-pyridin-3-yl-1,7-naphthyridin-2-one (PubChem CID 141351889) has the molecular formula C27H21N3O2 and a molecular weight of 419.48 g/mol. Its IUPAC name is 5-hydroxy-3-phenyl-1-(2-phenylethyl)-8-pyridin-3-yl-1,7-naphthyridin-2-one.

Molecular Properties

Compound Name5-hydroxy-3-phenyl-1-(2-phenylethyl)-8-pyridin-3-yl-1,7-naphthyridin-2-one
PubChem CID141351889
Molecular FormulaC27H21N3O2
Molecular Weight419.48 g/mol
Exact Mass419.16
IUPAC Name5-hydroxy-3-phenyl-1-(2-phenylethyl)-8-pyridin-3-yl-1,7-naphthyridin-2-one
SMILESO=c1c(-c2ccccc2)cc2c(O)cnc(-c3cccnc3)c2n1CCc1ccccc1
InChIInChI=1S/C27H21N3O2/c31-24-18-29-25(21-12-7-14-28-17-21)26-23(24)16-22(20-10-5-2-6-11-20)27(32)30(26)15-13-19-8-3-1-4-9-19/h1-12,14,16-18,31H,13,15H2
InChIKeyCJVYJZFAGPLBFT-UHFFFAOYSA-N
XLogP5.07
TPSA68.01 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500419.48
LogP ≤ 55.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

methyl 8-bromo-5-hydroxy-2-oxo-1-(2-phenylethyl)-3-pyridin-3-yl-1,7-naphthyridine-6-carboxylate
CID 174704591
1-benzyl-5-hydroxy-2-oxo-3-phenyl-1,7-naphthyridine-8-carbonitrile
CID 141351984
1-benzyl-N-cyclopropyl-5-hydroxy-2-oxo-3-phenyl-8-pyridin-3-yl-1,7-naphthyridine-6-carboxamide;carbonic acid
CID 122512383
4-[[5-hydroxy-2-oxo-3-phenyl-1-(2-phenylethyl)-8-(1,3-thiazol-4-yl)-1,7-naphthyridine-6-carbonyl]amino]butanoic acid
CID 175388733
6-fluoro-2-(2-hydroxyphenyl)-3-(2-pyridin-3-ylethyl)quinazolin-4-one
CID 135464225
1-benzyl-5-hydroxy-2-oxo-3-phenyl-8-pyridin-2-yl-1,7-naphthyridine-6-carboxylic acid
CID 141445763
1-oxo-2-(2-phenylethyl)-N-(pyridin-3-ylmethyl)isoquinoline-3-carboxamide
CID 172882568
2-benzyl-8-(5-fluoro-3-pyridinyl)-5-hydroxy-2,7-naphthyridin-1-one
CID 141351985
3-phenyl-2-pyridin-3-ylpyridine
CID 140510629
8-(2-phenylethyl)-2,8,13-triazatricyclo[7.4.0.02,6]trideca-1(9),3,5,10,12-pentaen-7-one
CID 110186700
3-(4-hydroxybutyl)-2-pyridin-3-ylquinazolin-4-one;hydrochloride
CID 135154211
3-(2-phenylethyl)-1H-pteridine-2,4-dione
CID 27558241

Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-3-phenyl-1-(2-phenylethyl)-8-pyridin-3-yl-1,7-naphthyridin-2-one?
The IUPAC name of 5-hydroxy-3-phenyl-1-(2-phenylethyl)-8-pyridin-3-yl-1,7-naphthyridin-2-one (CID 141351889) is 5-hydroxy-3-phenyl-1-(2-phenylethyl)-8-pyridin-3-yl-1,7-naphthyridin-2-one.
What is the SMILES notation for 5-hydroxy-3-phenyl-1-(2-phenylethyl)-8-pyridin-3-yl-1,7-naphthyridin-2-one?
The canonical SMILES for 5-hydroxy-3-phenyl-1-(2-phenylethyl)-8-pyridin-3-yl-1,7-naphthyridin-2-one is O=c1c(-c2ccccc2)cc2c(O)cnc(-c3cccnc3)c2n1CCc1ccccc1.
What is the InChIKey of 5-hydroxy-3-phenyl-1-(2-phenylethyl)-8-pyridin-3-yl-1,7-naphthyridin-2-one?
The InChIKey is CJVYJZFAGPLBFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H21N3O2/c31-24-18-29-25(21-12-7-14-28-17-21)26-23(24)16-22(20-10-5-2-6-11-20)27(32)30(26)15-13-19-8-3-1-4-9-19/h1-12,14,16-18,31H,13,15H2.
What are the key properties of 5-hydroxy-3-phenyl-1-(2-phenylethyl)-8-pyridin-3-yl-1,7-naphthyridin-2-one?
5-hydroxy-3-phenyl-1-(2-phenylethyl)-8-pyridin-3-yl-1,7-naphthyridin-2-one has a molecular weight of 419.48 g/mol, XLogP of 5.07, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-3-phenyl-1-(2-phenylethyl)-8-pyridin-3-yl-1,7-naphthyridin-2-one is sourced from PubChem (CID 141351889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).