4-(4-amino-8-fluoropyrido[4,3-d]pyrimidin-7-yl)naphthalen-2-ol

C17H11FN4O — CID 155630281

IUPAC4-(4-amino-8-fluoropyrido[4,3-d]pyrimidin-7-yl)naphthalen-2-ol
SMILESNc1ncnc2c(F)c(-c3cc(O)cc4ccccc34)ncc12
InChIInChI=1S/C17H11FN4O/c18-14-15(20-7-13-16(14)21-8-22-17(13)19)12-6-10(23)5-9-3-1-2-4-11(9)12/h1-8,23H,(H2,19,21,22)
InChIKeyWYJNCBGYKURRPP-UHFFFAOYSA-N
MW306.30 g/mol
LogP3.27
Rot. Bonds1

About 4-(4-amino-8-fluoropyrido[4,3-d]pyrimidin-7-yl)naphthalen-2-ol

4-(4-amino-8-fluoropyrido[4,3-d]pyrimidin-7-yl)naphthalen-2-ol (PubChem CID 155630281) has the molecular formula C17H11FN4O and a molecular weight of 306.30 g/mol. Its IUPAC name is 4-(4-amino-8-fluoropyrido[4,3-d]pyrimidin-7-yl)naphthalen-2-ol.

Molecular Properties

Compound Name4-(4-amino-8-fluoropyrido[4,3-d]pyrimidin-7-yl)naphthalen-2-ol
PubChem CID155630281
Molecular FormulaC17H11FN4O
Molecular Weight306.30 g/mol
Exact Mass306.09
IUPAC Name4-(4-amino-8-fluoropyrido[4,3-d]pyrimidin-7-yl)naphthalen-2-ol
SMILESNc1ncnc2c(F)c(-c3cc(O)cc4ccccc34)ncc12
InChIInChI=1S/C17H11FN4O/c18-14-15(20-7-13-16(14)21-8-22-17(13)19)12-6-10(23)5-9-3-1-2-4-11(9)12/h1-8,23H,(H2,19,21,22)
InChIKeyWYJNCBGYKURRPP-UHFFFAOYSA-N
XLogP3.27
TPSA84.92 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.30
LogP ≤ 53.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(cyanomethyl)-4-[8-fluoro-7-(3-hydroxynaphthalen-1-yl)pyrido[4,3-d]pyrimidin-4-yl]piperazine-1-carboxylic acid
CID 155210973
4-(4-fluoro-8-piperazin-1-yl-2,6-naphthyridin-3-yl)naphthalen-2-ol
CID 154984379
tert-butyl (2R)-4-[8-fluoro-7-(3-hydroxynaphthalen-1-yl)pyrido[4,3-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazine-1-carboxylate
CID 155630094
4-[2-(azetidin-1-yl)-4-(3,8-diazabicyclo[3.2.1]octan-3-yl)-8-fluoropyrido[4,3-d]pyrimidin-7-yl]naphthalen-2-ol;methanol
CID 156645490
4-[4-(3-azabicyclo[3.2.1]octan-3-yl)-8-fluoro-2-propoxypyrido[4,3-d]pyrimidin-7-yl]naphthalen-2-ol
CID 167691036
4-[8-fluoro-2-methoxy-4-(3-methylpiperidin-1-yl)pyrido[4,3-d]pyrimidin-7-yl]naphthalen-2-ol
CID 166157405
4-[4-(3-azabicyclo[3.2.1]octan-3-yl)-2-(2-azaspiro[3.5]nonan-2-yl)-8-fluoropyrido[4,3-d]pyrimidin-7-yl]naphthalen-2-ol
CID 167532942
4-[4-(3-azabicyclo[3.2.1]octan-3-yl)-8-fluoro-2-(2-methoxyethoxy)pyrido[4,3-d]pyrimidin-7-yl]naphthalen-2-ol
CID 167596130
4-[4-(4-tert-butylpiperazin-1-yl)-8-fluoropyrido[4,3-d]pyrimidin-7-yl]naphthalene-2-carbonitrile
CID 155211008
tert-butyl 4-[8-fluoro-7-(3-methylnaphthalen-1-yl)pyrido[4,3-d]pyrimidin-4-yl]piperazine-1-carboxylate
CID 154644390
4-[4-[(1S,5R)-3,8-diazabicyclo[3.2.1]octan-3-yl]-8-fluoro-2-(3,3,3-trifluoropropoxy)pyrido[4,3-d]pyrimidin-7-yl]naphthalen-2-ol
CID 164521427
4-[8-fluoro-4-(3-methyl-3-azabicyclo[4.1.0]heptan-6-yl)-2-methylsulfinylpyrido[4,3-d]pyrimidin-7-yl]naphthalen-2-ol
CID 168899682

Frequently Asked Questions

What is the IUPAC name of 4-(4-amino-8-fluoropyrido[4,3-d]pyrimidin-7-yl)naphthalen-2-ol?
The IUPAC name of 4-(4-amino-8-fluoropyrido[4,3-d]pyrimidin-7-yl)naphthalen-2-ol (CID 155630281) is 4-(4-amino-8-fluoropyrido[4,3-d]pyrimidin-7-yl)naphthalen-2-ol.
What is the SMILES notation for 4-(4-amino-8-fluoropyrido[4,3-d]pyrimidin-7-yl)naphthalen-2-ol?
The canonical SMILES for 4-(4-amino-8-fluoropyrido[4,3-d]pyrimidin-7-yl)naphthalen-2-ol is Nc1ncnc2c(F)c(-c3cc(O)cc4ccccc34)ncc12.
What is the InChIKey of 4-(4-amino-8-fluoropyrido[4,3-d]pyrimidin-7-yl)naphthalen-2-ol?
The InChIKey is WYJNCBGYKURRPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11FN4O/c18-14-15(20-7-13-16(14)21-8-22-17(13)19)12-6-10(23)5-9-3-1-2-4-11(9)12/h1-8,23H,(H2,19,21,22).
What are the key properties of 4-(4-amino-8-fluoropyrido[4,3-d]pyrimidin-7-yl)naphthalen-2-ol?
4-(4-amino-8-fluoropyrido[4,3-d]pyrimidin-7-yl)naphthalen-2-ol has a molecular weight of 306.30 g/mol, XLogP of 3.27, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-amino-8-fluoropyrido[4,3-d]pyrimidin-7-yl)naphthalen-2-ol is sourced from PubChem (CID 155630281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).