6-[2-(3-fluoro-6-methoxy-1,5-naphthyridin-4-yl)ethyl]piperidin-3-amine

C16H21FN4O — CID 141165400

IUPAC6-[2-(3-fluoro-6-methoxy-1,5-naphthyridin-4-yl)ethyl]piperidin-3-amine
SMILESCOc1ccc2ncc(F)c(CCC3CCC(N)CN3)c2n1
InChIInChI=1S/C16H21FN4O/c1-22-15-7-6-14-16(21-15)12(13(17)9-20-14)5-4-11-3-2-10(18)8-19-11/h6-7,9-11,19H,2-5,8,18H2,1H3
InChIKeyOKNYVTBNNRVOAZ-UHFFFAOYSA-N
MW304.37 g/mol
LogP1.79
Rot. Bonds4

About 6-[2-(3-fluoro-6-methoxy-1,5-naphthyridin-4-yl)ethyl]piperidin-3-amine

6-[2-(3-fluoro-6-methoxy-1,5-naphthyridin-4-yl)ethyl]piperidin-3-amine (PubChem CID 141165400) has the molecular formula C16H21FN4O and a molecular weight of 304.37 g/mol. Its IUPAC name is 6-[2-(3-fluoro-6-methoxy-1,5-naphthyridin-4-yl)ethyl]piperidin-3-amine.

Molecular Properties

Compound Name6-[2-(3-fluoro-6-methoxy-1,5-naphthyridin-4-yl)ethyl]piperidin-3-amine
PubChem CID141165400
Molecular FormulaC16H21FN4O
Molecular Weight304.37 g/mol
Exact Mass304.17
IUPAC Name6-[2-(3-fluoro-6-methoxy-1,5-naphthyridin-4-yl)ethyl]piperidin-3-amine
SMILESCOc1ccc2ncc(F)c(CCC3CCC(N)CN3)c2n1
InChIInChI=1S/C16H21FN4O/c1-22-15-7-6-14-16(21-15)12(13(17)9-20-14)5-4-11-3-2-10(18)8-19-11/h6-7,9-11,19H,2-5,8,18H2,1H3
InChIKeyOKNYVTBNNRVOAZ-UHFFFAOYSA-N
XLogP1.79
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.37
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-[2-(3-fluoro-6-methoxy-1,5-naphthyridin-4-yl)ethyl]piperidin-3-amine?
The IUPAC name of 6-[2-(3-fluoro-6-methoxy-1,5-naphthyridin-4-yl)ethyl]piperidin-3-amine (CID 141165400) is 6-[2-(3-fluoro-6-methoxy-1,5-naphthyridin-4-yl)ethyl]piperidin-3-amine.
What is the SMILES notation for 6-[2-(3-fluoro-6-methoxy-1,5-naphthyridin-4-yl)ethyl]piperidin-3-amine?
The canonical SMILES for 6-[2-(3-fluoro-6-methoxy-1,5-naphthyridin-4-yl)ethyl]piperidin-3-amine is COc1ccc2ncc(F)c(CCC3CCC(N)CN3)c2n1.
What is the InChIKey of 6-[2-(3-fluoro-6-methoxy-1,5-naphthyridin-4-yl)ethyl]piperidin-3-amine?
The InChIKey is OKNYVTBNNRVOAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21FN4O/c1-22-15-7-6-14-16(21-15)12(13(17)9-20-14)5-4-11-3-2-10(18)8-19-11/h6-7,9-11,19H,2-5,8,18H2,1H3.
What are the key properties of 6-[2-(3-fluoro-6-methoxy-1,5-naphthyridin-4-yl)ethyl]piperidin-3-amine?
6-[2-(3-fluoro-6-methoxy-1,5-naphthyridin-4-yl)ethyl]piperidin-3-amine has a molecular weight of 304.37 g/mol, XLogP of 1.79, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(3-fluoro-6-methoxy-1,5-naphthyridin-4-yl)ethyl]piperidin-3-amine is sourced from PubChem (CID 141165400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).