6-(4-fluorophenyl)-1-methylpyrido[2,3-d]pyrimidine-2,4-dione

C14H10FN3O2 — CID 110171943

IUPAC6-(4-fluorophenyl)-1-methylpyrido[2,3-d]pyrimidine-2,4-dione
SMILESCn1c(=O)[nH]c(=O)c2cc(-c3ccc(F)cc3)cnc21
InChIInChI=1S/C14H10FN3O2/c1-18-12-11(13(19)17-14(18)20)6-9(7-16-12)8-2-4-10(15)5-3-8/h2-7H,1H3,(H,17,19,20)
InChIKeyOKQVVXDSLJKSCO-UHFFFAOYSA-N
MW271.25 g/mol
LogP1.43
Rot. Bonds1

About 6-(4-fluorophenyl)-1-methylpyrido[2,3-d]pyrimidine-2,4-dione

6-(4-fluorophenyl)-1-methylpyrido[2,3-d]pyrimidine-2,4-dione (PubChem CID 110171943) has the molecular formula C14H10FN3O2 and a molecular weight of 271.25 g/mol. Its IUPAC name is 6-(4-fluorophenyl)-1-methylpyrido[2,3-d]pyrimidine-2,4-dione.

Molecular Properties

Compound Name6-(4-fluorophenyl)-1-methylpyrido[2,3-d]pyrimidine-2,4-dione
PubChem CID110171943
Molecular FormulaC14H10FN3O2
Molecular Weight271.25 g/mol
Exact Mass271.08
IUPAC Name6-(4-fluorophenyl)-1-methylpyrido[2,3-d]pyrimidine-2,4-dione
SMILESCn1c(=O)[nH]c(=O)c2cc(-c3ccc(F)cc3)cnc21
InChIInChI=1S/C14H10FN3O2/c1-18-12-11(13(19)17-14(18)20)6-9(7-16-12)8-2-4-10(15)5-3-8/h2-7H,1H3,(H,17,19,20)
InChIKeyOKQVVXDSLJKSCO-UHFFFAOYSA-N
XLogP1.43
TPSA67.75 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.25
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-(3,3-dimethylindol-2-yl)-1-methylpyrido[2,3-d]pyrimidine-2,4-dione
CID 139220049
6-(4-fluoro-3-methylphenyl)-3-methyl-1H-imidazo[4,5-b]pyridin-2-one
CID 134489898
N-[3-(4-fluorophenyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-6-yl]-1-methyl-2,4-dioxopyrido[2,3-d]pyrimidine-6-carboxamide
CID 154806982
6-benzyl-1-methylpyrido[2,3-d]pyrimidine-2,4-dione
CID 12028356
6-[3-(difluoromethyl)-4-fluorophenyl]-3-methyl-1H-imidazo[4,5-b]pyridin-2-one
CID 134489921
6-(3,4-dimethoxyphenyl)-1-phenylpyrido[2,3-d]pyrimidine-2,4-dione
CID 110171949
N-[3-(3-fluorophenyl)cyclobutyl]-1-methyl-2,4-dioxopyrido[2,3-d]pyrimidine-6-carboxamide
CID 154800554
6-[4-(3,4-difluorobenzoyl)piperazine-1-carbonyl]-1-methylpyrido[2,3-d]pyrimidine-2,4-dione
CID 167771663
1-methyl-6-[(propan-2-ylamino)methyl]pyrido[2,3-d]pyrimidine-2,4-dione
CID 63772557
7-(4-chlorophenyl)-1-methylpyrimido[4,5-d]pyrimidine-2,4-dione
CID 46503580
1-benzyl-6-(3,4-dimethoxyphenyl)pyrido[2,3-d]pyrimidine-2,4-dione
CID 110171948
N,1-dimethyl-N-[2-(4-methylphenoxy)ethyl]-2,4-dioxopyrido[2,3-d]pyrimidine-6-carboxamide
CID 24632369

Frequently Asked Questions

What is the IUPAC name of 6-(4-fluorophenyl)-1-methylpyrido[2,3-d]pyrimidine-2,4-dione?
The IUPAC name of 6-(4-fluorophenyl)-1-methylpyrido[2,3-d]pyrimidine-2,4-dione (CID 110171943) is 6-(4-fluorophenyl)-1-methylpyrido[2,3-d]pyrimidine-2,4-dione.
What is the SMILES notation for 6-(4-fluorophenyl)-1-methylpyrido[2,3-d]pyrimidine-2,4-dione?
The canonical SMILES for 6-(4-fluorophenyl)-1-methylpyrido[2,3-d]pyrimidine-2,4-dione is Cn1c(=O)[nH]c(=O)c2cc(-c3ccc(F)cc3)cnc21.
What is the InChIKey of 6-(4-fluorophenyl)-1-methylpyrido[2,3-d]pyrimidine-2,4-dione?
The InChIKey is OKQVVXDSLJKSCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10FN3O2/c1-18-12-11(13(19)17-14(18)20)6-9(7-16-12)8-2-4-10(15)5-3-8/h2-7H,1H3,(H,17,19,20).
What are the key properties of 6-(4-fluorophenyl)-1-methylpyrido[2,3-d]pyrimidine-2,4-dione?
6-(4-fluorophenyl)-1-methylpyrido[2,3-d]pyrimidine-2,4-dione has a molecular weight of 271.25 g/mol, XLogP of 1.43, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-fluorophenyl)-1-methylpyrido[2,3-d]pyrimidine-2,4-dione is sourced from PubChem (CID 110171943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).