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

C19H16F2N4O2 — CID 166123747

About 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

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 (PubChem CID 166123747) has the molecular formula C19H16F2N4O2 and a molecular weight of 370.36 g/mol. Its IUPAC name is 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.

Molecular Properties

• Compound Name: 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
• PubChem CID: 166123747
• Molecular Formula: C19H16F2N4O2
• Molecular Weight: 370.36 g/mol
• Exact Mass: 370.12
• IUPAC Name: 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
• SMILES: Cc1c(F)cncc1-c1cc2cnc(NC(=O)[C@H]3C[C@H]3F)cc2n(C)c1=O
• InChI: InChI=1S/C19H16F2N4O2/c1-9-13(7-22-8-15(9)21)11-3-10-6-23-17(5-16(10)25(2)19(11)27)24-18(26)12-4-14(12)20/h3,5-8,12,14H,4H2,1-2H3,(H,23,24,26)/t12-,14+/m0/s1
• InChIKey: ZTVVCFPBVBLXET-GXTWGEPZSA-N
• XLogP: 2.74
• TPSA: 76.88 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 3
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	370.36
LogP ≤ 5	2.74
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of 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?

The IUPAC name of 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) is 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.

What is the SMILES notation for 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?

The canonical SMILES for 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 is Cc1c(F)cncc1-c1cc2cnc(NC(=O)[C@H]3C[C@H]3F)cc2n(C)c1=O.

What is the InChIKey of 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?

The InChIKey is ZTVVCFPBVBLXET-GXTWGEPZSA-N. The full InChI is InChI=1S/C19H16F2N4O2/c1-9-13(7-22-8-15(9)21)11-3-10-6-23-17(5-16(10)25(2)19(11)27)24-18(26)12-4-14(12)20/h3,5-8,12,14H,4H2,1-2H3,(H,23,24,26)/t12-,14+/m0/s1.

What are the key properties of 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?

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 has a molecular weight of 370.36 g/mol, XLogP of 2.74, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 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 is sourced from PubChem (CID 166123747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).