N-(6-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl)-5-methyl-2,4-dioxo-1H-pyrido[2,3-d]pyrimidine-7-carboxamide

C19H17FN4O3 — CID 126773254

IUPACN-(6-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl)-5-methyl-2,4-dioxo-1H-pyrido[2,3-d]pyrimidine-7-carboxamide
SMILESCc1cc(C(=O)NC2CCCc3cc(F)ccc32)nc2[nH]c(=O)[nH]c(=O)c12
InChIInChI=1S/C19H17FN4O3/c1-9-7-14(21-16-15(9)18(26)24-19(27)23-16)17(25)22-13-4-2-3-10-8-11(20)5-6-12(10)13/h5-8,13H,2-4H2,1H3,(H,22,25)(H2,21,23,24,26,27)
InChIKeyVVXWUJCHHJIETO-UHFFFAOYSA-N
MW368.37 g/mol
LogP1.87
Rot. Bonds2

About N-(6-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl)-5-methyl-2,4-dioxo-1H-pyrido[2,3-d]pyrimidine-7-carboxamide

N-(6-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl)-5-methyl-2,4-dioxo-1H-pyrido[2,3-d]pyrimidine-7-carboxamide (PubChem CID 126773254) has the molecular formula C19H17FN4O3 and a molecular weight of 368.37 g/mol. Its IUPAC name is N-(6-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl)-5-methyl-2,4-dioxo-1H-pyrido[2,3-d]pyrimidine-7-carboxamide.

Molecular Properties

Compound NameN-(6-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl)-5-methyl-2,4-dioxo-1H-pyrido[2,3-d]pyrimidine-7-carboxamide
PubChem CID126773254
Molecular FormulaC19H17FN4O3
Molecular Weight368.37 g/mol
Exact Mass368.13
IUPAC NameN-(6-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl)-5-methyl-2,4-dioxo-1H-pyrido[2,3-d]pyrimidine-7-carboxamide
SMILESCc1cc(C(=O)NC2CCCc3cc(F)ccc32)nc2[nH]c(=O)[nH]c(=O)c12
InChIInChI=1S/C19H17FN4O3/c1-9-7-14(21-16-15(9)18(26)24-19(27)23-16)17(25)22-13-4-2-3-10-8-11(20)5-6-12(10)13/h5-8,13H,2-4H2,1H3,(H,22,25)(H2,21,23,24,26,27)
InChIKeyVVXWUJCHHJIETO-UHFFFAOYSA-N
XLogP1.87
TPSA107.71 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.37
LogP ≤ 51.87
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze N-(6-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl)-5-methyl-2,4-dioxo-1H-pyrido[2,3-d]pyrimidine-7-carboxamide with MolForge

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Related Compounds

N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-5-methyl-1H-pyrazole-3-carboxamide
CID 47380214
N-[[1-(3-fluorophenyl)cyclopropyl]methyl]-5-methyl-2,4-dioxo-1H-pyrido[2,3-d]pyrimidine-7-carboxamide
CID 126785835
N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-5-methyl-1,2-oxazole-3-carboxamide
CID 47387060
(2R)-N-[(1R)-6-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl]-6-oxopiperidine-2-carboxamide
CID 146129673
7-(5,7-difluoro-3,4-dihydro-1H-isoquinoline-2-carbonyl)-5-methyl-1H-pyrido[2,3-d]pyrimidine-2,4-dione
CID 154840042
3-(aminomethyl)-N-[(1R)-6-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl]benzamide
CID 124854722
N-(3-acetyl-4-fluorophenyl)-5-methyl-2,4-dioxo-1H-pyrido[2,3-d]pyrimidine-7-carboxamide
CID 167936599
5-methyl-2,4-dioxo-N-(2-pyrrolidin-3-ylethyl)-1H-pyrido[2,3-d]pyrimidine-7-carboxamide
CID 119537574
2,5-difluoro-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]benzamide
CID 27184099
2-amino-N-[(1R)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]-6-methylpyrimidine-4-carboxamide
CID 125157762
5-methyl-N-[[2-(4-methylphenyl)oxan-3-yl]methyl]-2,4-dioxo-1H-pyrido[2,3-d]pyrimidine-7-carboxamide
CID 154839354
N-[(1R)-6-(difluoromethoxy)-1,2,3,4-tetrahydronaphthalen-1-yl]-3,4-dimethyl-6-oxo-1H-pyridazine-5-carboxamide
CID 95346205

Frequently Asked Questions

What is the IUPAC name of N-(6-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl)-5-methyl-2,4-dioxo-1H-pyrido[2,3-d]pyrimidine-7-carboxamide?
The IUPAC name of N-(6-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl)-5-methyl-2,4-dioxo-1H-pyrido[2,3-d]pyrimidine-7-carboxamide (CID 126773254) is N-(6-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl)-5-methyl-2,4-dioxo-1H-pyrido[2,3-d]pyrimidine-7-carboxamide.
What is the SMILES notation for N-(6-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl)-5-methyl-2,4-dioxo-1H-pyrido[2,3-d]pyrimidine-7-carboxamide?
The canonical SMILES for N-(6-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl)-5-methyl-2,4-dioxo-1H-pyrido[2,3-d]pyrimidine-7-carboxamide is Cc1cc(C(=O)NC2CCCc3cc(F)ccc32)nc2[nH]c(=O)[nH]c(=O)c12.
What is the InChIKey of N-(6-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl)-5-methyl-2,4-dioxo-1H-pyrido[2,3-d]pyrimidine-7-carboxamide?
The InChIKey is VVXWUJCHHJIETO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17FN4O3/c1-9-7-14(21-16-15(9)18(26)24-19(27)23-16)17(25)22-13-4-2-3-10-8-11(20)5-6-12(10)13/h5-8,13H,2-4H2,1H3,(H,22,25)(H2,21,23,24,26,27).
What are the key properties of N-(6-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl)-5-methyl-2,4-dioxo-1H-pyrido[2,3-d]pyrimidine-7-carboxamide?
N-(6-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl)-5-methyl-2,4-dioxo-1H-pyrido[2,3-d]pyrimidine-7-carboxamide has a molecular weight of 368.37 g/mol, XLogP of 1.87, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl)-5-methyl-2,4-dioxo-1H-pyrido[2,3-d]pyrimidine-7-carboxamide is sourced from PubChem (CID 126773254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).