N-methoxy-N-methyl-2-(trifluoromethyl)-1,8-naphthyridine-3-carboxamide

C12H10F3N3O2 — CID 4246738

IUPACN-methoxy-N-methyl-2-(trifluoromethyl)-1,8-naphthyridine-3-carboxamide
SMILESCON(C)C(=O)c1cc2cccnc2nc1C(F)(F)F
InChIInChI=1S/C12H10F3N3O2/c1-18(20-2)11(19)8-6-7-4-3-5-16-10(7)17-9(8)12(13,14)15/h3-6H,1-2H3
InChIKeyRWRDHSZZGBOMQL-UHFFFAOYSA-N
MW285.23 g/mol
LogP2.28
Rot. Bonds2

About N-methoxy-N-methyl-2-(trifluoromethyl)-1,8-naphthyridine-3-carboxamide

N-methoxy-N-methyl-2-(trifluoromethyl)-1,8-naphthyridine-3-carboxamide (PubChem CID 4246738) has the molecular formula C12H10F3N3O2 and a molecular weight of 285.23 g/mol. Its IUPAC name is N-methoxy-N-methyl-2-(trifluoromethyl)-1,8-naphthyridine-3-carboxamide.

Molecular Properties

Compound NameN-methoxy-N-methyl-2-(trifluoromethyl)-1,8-naphthyridine-3-carboxamide
PubChem CID4246738
Molecular FormulaC12H10F3N3O2
Molecular Weight285.23 g/mol
Exact Mass285.07
IUPAC NameN-methoxy-N-methyl-2-(trifluoromethyl)-1,8-naphthyridine-3-carboxamide
SMILESCON(C)C(=O)c1cc2cccnc2nc1C(F)(F)F
InChIInChI=1S/C12H10F3N3O2/c1-18(20-2)11(19)8-6-7-4-3-5-16-10(7)17-9(8)12(13,14)15/h3-6H,1-2H3
InChIKeyRWRDHSZZGBOMQL-UHFFFAOYSA-N
XLogP2.28
TPSA55.32 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.23
LogP ≤ 52.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-methoxy-N-methyl-2-(trifluoromethyl)-1,8-naphthyridine-3-carboxamide?
The IUPAC name of N-methoxy-N-methyl-2-(trifluoromethyl)-1,8-naphthyridine-3-carboxamide (CID 4246738) is N-methoxy-N-methyl-2-(trifluoromethyl)-1,8-naphthyridine-3-carboxamide.
What is the SMILES notation for N-methoxy-N-methyl-2-(trifluoromethyl)-1,8-naphthyridine-3-carboxamide?
The canonical SMILES for N-methoxy-N-methyl-2-(trifluoromethyl)-1,8-naphthyridine-3-carboxamide is CON(C)C(=O)c1cc2cccnc2nc1C(F)(F)F.
What is the InChIKey of N-methoxy-N-methyl-2-(trifluoromethyl)-1,8-naphthyridine-3-carboxamide?
The InChIKey is RWRDHSZZGBOMQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10F3N3O2/c1-18(20-2)11(19)8-6-7-4-3-5-16-10(7)17-9(8)12(13,14)15/h3-6H,1-2H3.
What are the key properties of N-methoxy-N-methyl-2-(trifluoromethyl)-1,8-naphthyridine-3-carboxamide?
N-methoxy-N-methyl-2-(trifluoromethyl)-1,8-naphthyridine-3-carboxamide has a molecular weight of 285.23 g/mol, XLogP of 2.28, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-N-methyl-2-(trifluoromethyl)-1,8-naphthyridine-3-carboxamide is sourced from PubChem (CID 4246738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).