N-[1-ethyl-3-(4-methyl-3-pyridinyl)-2-oxo-1,6-naphthyridin-7-yl]-2-fluorocyclopropane-1-carboxamide

C20H19FN4O2 — CID 166123847

IUPACN-[1-ethyl-3-(4-methyl-3-pyridinyl)-2-oxo-1,6-naphthyridin-7-yl]-2-fluorocyclopropane-1-carboxamide
SMILESCCn1c(=O)c(-c2cnccc2C)cc2cnc(NC(=O)C3CC3F)cc21
InChIInChI=1S/C20H19FN4O2/c1-3-25-17-8-18(24-19(26)14-7-16(14)21)23-9-12(17)6-13(20(25)27)15-10-22-5-4-11(15)2/h4-6,8-10,14,16H,3,7H2,1-2H3,(H,23,24,26)
InChIKeyLEANLYJLYCIEMP-UHFFFAOYSA-N
MW366.40 g/mol
LogP3.08
Rot. Bonds4

About N-[1-ethyl-3-(4-methyl-3-pyridinyl)-2-oxo-1,6-naphthyridin-7-yl]-2-fluorocyclopropane-1-carboxamide

N-[1-ethyl-3-(4-methyl-3-pyridinyl)-2-oxo-1,6-naphthyridin-7-yl]-2-fluorocyclopropane-1-carboxamide (PubChem CID 166123847) has the molecular formula C20H19FN4O2 and a molecular weight of 366.40 g/mol. Its IUPAC name is N-[1-ethyl-3-(4-methyl-3-pyridinyl)-2-oxo-1,6-naphthyridin-7-yl]-2-fluorocyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-[1-ethyl-3-(4-methyl-3-pyridinyl)-2-oxo-1,6-naphthyridin-7-yl]-2-fluorocyclopropane-1-carboxamide
PubChem CID166123847
Molecular FormulaC20H19FN4O2
Molecular Weight366.40 g/mol
Exact Mass366.15
IUPAC NameN-[1-ethyl-3-(4-methyl-3-pyridinyl)-2-oxo-1,6-naphthyridin-7-yl]-2-fluorocyclopropane-1-carboxamide
SMILESCCn1c(=O)c(-c2cnccc2C)cc2cnc(NC(=O)C3CC3F)cc21
InChIInChI=1S/C20H19FN4O2/c1-3-25-17-8-18(24-19(26)14-7-16(14)21)23-9-12(17)6-13(20(25)27)15-10-22-5-4-11(15)2/h4-6,8-10,14,16H,3,7H2,1-2H3,(H,23,24,26)
InChIKeyLEANLYJLYCIEMP-UHFFFAOYSA-N
XLogP3.08
TPSA76.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.40
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[1-ethyl-3-(4-methyl-3-pyridinyl)-2-oxo-1,6-naphthyridin-7-yl]-2-fluorocyclopropane-1-carboxamide with MolForge

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Related Compounds

cis-(1S,2S)-N-[1-(cyclopropylmethyl)-3-[4-[[2-[[7-[(2-fluorocyclopropanecarbonyl)amino]-3-(4-methyl-3-pyridinyl)-2-oxo-1,6-naphthyridin-1-yl]methyl]cyclopropyl]methyl]-3-pyridinyl]-2-oxo-1,6-naphthyridin-7-yl]-2-fluorocyclopropane-1-carboxamide
CID 167188740
cis-(1R,2R)-2-fluoro-N-[7-(4-methyl-3-pyridinyl)isoquinolin-3-yl]cyclopropane-1-carboxamide
CID 71115022
2-fluoro-N-[3-(5-fluoro-2-methylphenyl)-1-methyl-2-oxo-1,6-naphthyridin-7-yl]cyclopropane-1-carboxamide
CID 166123806
cis-(1R,2R)-2-fluoro-N-[3-[6-(4-fluorobutanoyl)-4-methyl-3-pyridinyl]-1-methyl-2-oxo-1,6-naphthyridin-7-yl]cyclopropane-1-carboxamide
CID 171556510
cis-(1R,2R)-2-fluoro-N-[3-(5-fluoro-4-methyl-3-pyridinyl)-1-methyl-2-oxo-1,6-naphthyridin-7-yl]cyclopropane-1-carboxamide
CID 166123747
2-fluoro-N-[3-[4-[2-[7-[[(1R,2S)-2-fluorocyclopropanecarbonyl]amino]-3-(5-fluoro-4-methyl-3-pyridinyl)-2-oxo-1,6-naphthyridin-1-yl]ethyl]-3-pyridinyl]-2-oxo-1H-1,6-naphthyridin-7-yl]cyclopropane-1-carboxamide
CID 167188961
cis-(1R,2R)-2-fluoro-N-[3-[6-[(1S)-1-hydroxyethyl]-4-methyl-3-pyridinyl]-1-methyl-2-oxo-1,6-naphthyridin-7-yl]cyclopropane-1-carboxamide
CID 166123775
cis-(1R,2R)-2-fluoro-N-[4-(4-methyl-6-propanoyl-3-pyridinyl)imidazo[1,2-a][1,6]naphthyridin-8-yl]cyclopropane-1-carboxamide
CID 170967989
CID 166123464
CID 166123464
2-fluoro-N-[2-hydroxy-1-methyl-3-(4-methyl-3-pyridinyl)-2H-1,6-naphthyridin-7-yl]cyclopropane-1-carboxamide
CID 167188940
cis-(1R,2R)-2-fluoro-N-[4-[6-[(1S)-1-hydroxypropyl]-4-methyl-3-pyridinyl]imidazo[1,2-a][1,6]naphthyridin-8-yl]cyclopropane-1-carboxamide
CID 170967810
cis-(1S,2S)-2-fluoro-N-[1-methyl-3-[4-methyl-6-[(1S)-2,2,2-trifluoro-1-hydroxyethyl]-3-pyridinyl]-2-oxo-1,6-naphthyridin-7-yl]cyclopropane-1-carboxamide
CID 166123711

Frequently Asked Questions

What is the IUPAC name of N-[1-ethyl-3-(4-methyl-3-pyridinyl)-2-oxo-1,6-naphthyridin-7-yl]-2-fluorocyclopropane-1-carboxamide?
The IUPAC name of N-[1-ethyl-3-(4-methyl-3-pyridinyl)-2-oxo-1,6-naphthyridin-7-yl]-2-fluorocyclopropane-1-carboxamide (CID 166123847) is N-[1-ethyl-3-(4-methyl-3-pyridinyl)-2-oxo-1,6-naphthyridin-7-yl]-2-fluorocyclopropane-1-carboxamide.
What is the SMILES notation for N-[1-ethyl-3-(4-methyl-3-pyridinyl)-2-oxo-1,6-naphthyridin-7-yl]-2-fluorocyclopropane-1-carboxamide?
The canonical SMILES for N-[1-ethyl-3-(4-methyl-3-pyridinyl)-2-oxo-1,6-naphthyridin-7-yl]-2-fluorocyclopropane-1-carboxamide is CCn1c(=O)c(-c2cnccc2C)cc2cnc(NC(=O)C3CC3F)cc21.
What is the InChIKey of N-[1-ethyl-3-(4-methyl-3-pyridinyl)-2-oxo-1,6-naphthyridin-7-yl]-2-fluorocyclopropane-1-carboxamide?
The InChIKey is LEANLYJLYCIEMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19FN4O2/c1-3-25-17-8-18(24-19(26)14-7-16(14)21)23-9-12(17)6-13(20(25)27)15-10-22-5-4-11(15)2/h4-6,8-10,14,16H,3,7H2,1-2H3,(H,23,24,26).
What are the key properties of N-[1-ethyl-3-(4-methyl-3-pyridinyl)-2-oxo-1,6-naphthyridin-7-yl]-2-fluorocyclopropane-1-carboxamide?
N-[1-ethyl-3-(4-methyl-3-pyridinyl)-2-oxo-1,6-naphthyridin-7-yl]-2-fluorocyclopropane-1-carboxamide has a molecular weight of 366.40 g/mol, XLogP of 3.08, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-ethyl-3-(4-methyl-3-pyridinyl)-2-oxo-1,6-naphthyridin-7-yl]-2-fluorocyclopropane-1-carboxamide is sourced from PubChem (CID 166123847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).