2-[7-[[6-(trifluoromethyl)-2-pyridinyl]methoxy]-1,5-naphthyridin-3-yl]acetamide

C17H13F3N4O2 — CID 86296851

IUPAC2-[7-[[6-(trifluoromethyl)-2-pyridinyl]methoxy]-1,5-naphthyridin-3-yl]acetamide
SMILESNC(=O)Cc1cnc2cc(OCc3cccc(C(F)(F)F)n3)cnc2c1
InChIInChI=1S/C17H13F3N4O2/c18-17(19,20)15-3-1-2-11(24-15)9-26-12-6-14-13(23-8-12)4-10(7-22-14)5-16(21)25/h1-4,6-8H,5,9H2,(H2,21,25)
InChIKeySDNPYSRYNPYNDS-UHFFFAOYSA-N
MW362.31 g/mol
LogP2.65
Rot. Bonds5

About 2-[7-[[6-(trifluoromethyl)-2-pyridinyl]methoxy]-1,5-naphthyridin-3-yl]acetamide

2-[7-[[6-(trifluoromethyl)-2-pyridinyl]methoxy]-1,5-naphthyridin-3-yl]acetamide (PubChem CID 86296851) has the molecular formula C17H13F3N4O2 and a molecular weight of 362.31 g/mol. Its IUPAC name is 2-[7-[[6-(trifluoromethyl)-2-pyridinyl]methoxy]-1,5-naphthyridin-3-yl]acetamide.

Molecular Properties

Compound Name2-[7-[[6-(trifluoromethyl)-2-pyridinyl]methoxy]-1,5-naphthyridin-3-yl]acetamide
PubChem CID86296851
Molecular FormulaC17H13F3N4O2
Molecular Weight362.31 g/mol
Exact Mass362.10
IUPAC Name2-[7-[[6-(trifluoromethyl)-2-pyridinyl]methoxy]-1,5-naphthyridin-3-yl]acetamide
SMILESNC(=O)Cc1cnc2cc(OCc3cccc(C(F)(F)F)n3)cnc2c1
InChIInChI=1S/C17H13F3N4O2/c18-17(19,20)15-3-1-2-11(24-15)9-26-12-6-14-13(23-8-12)4-10(7-22-14)5-16(21)25/h1-4,6-8H,5,9H2,(H2,21,25)
InChIKeySDNPYSRYNPYNDS-UHFFFAOYSA-N
XLogP2.65
TPSA90.99 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.31
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[7-[[6-(trifluoromethyl)-2-pyridinyl]methoxy]-1,5-naphthyridin-3-yl]acetamide?
The IUPAC name of 2-[7-[[6-(trifluoromethyl)-2-pyridinyl]methoxy]-1,5-naphthyridin-3-yl]acetamide (CID 86296851) is 2-[7-[[6-(trifluoromethyl)-2-pyridinyl]methoxy]-1,5-naphthyridin-3-yl]acetamide.
What is the SMILES notation for 2-[7-[[6-(trifluoromethyl)-2-pyridinyl]methoxy]-1,5-naphthyridin-3-yl]acetamide?
The canonical SMILES for 2-[7-[[6-(trifluoromethyl)-2-pyridinyl]methoxy]-1,5-naphthyridin-3-yl]acetamide is NC(=O)Cc1cnc2cc(OCc3cccc(C(F)(F)F)n3)cnc2c1.
What is the InChIKey of 2-[7-[[6-(trifluoromethyl)-2-pyridinyl]methoxy]-1,5-naphthyridin-3-yl]acetamide?
The InChIKey is SDNPYSRYNPYNDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13F3N4O2/c18-17(19,20)15-3-1-2-11(24-15)9-26-12-6-14-13(23-8-12)4-10(7-22-14)5-16(21)25/h1-4,6-8H,5,9H2,(H2,21,25).
What are the key properties of 2-[7-[[6-(trifluoromethyl)-2-pyridinyl]methoxy]-1,5-naphthyridin-3-yl]acetamide?
2-[7-[[6-(trifluoromethyl)-2-pyridinyl]methoxy]-1,5-naphthyridin-3-yl]acetamide has a molecular weight of 362.31 g/mol, XLogP of 2.65, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[7-[[6-(trifluoromethyl)-2-pyridinyl]methoxy]-1,5-naphthyridin-3-yl]acetamide is sourced from PubChem (CID 86296851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).