1-[2-(4-aminopiperidin-1-yl)ethyl]-7-fluoro-1,5-naphthyridin-2-one;hydrochloride

C15H20ClFN4O — CID 68927113

IUPAC1-[2-(4-aminopiperidin-1-yl)ethyl]-7-fluoro-1,5-naphthyridin-2-one;hydrochloride
SMILESCl.NC1CCN(CCn2c(=O)ccc3ncc(F)cc32)CC1
InChIInChI=1S/C15H19FN4O.ClH/c16-11-9-14-13(18-10-11)1-2-15(21)20(14)8-7-19-5-3-12(17)4-6-19;/h1-2,9-10,12H,3-8,17H2;1H
InChIKeyVGIJDAFEQOIGBO-UHFFFAOYSA-N
MW326.80 g/mol
LogP1.38
Rot. Bonds3

About 1-[2-(4-aminopiperidin-1-yl)ethyl]-7-fluoro-1,5-naphthyridin-2-one;hydrochloride

1-[2-(4-aminopiperidin-1-yl)ethyl]-7-fluoro-1,5-naphthyridin-2-one;hydrochloride (PubChem CID 68927113) has the molecular formula C15H20ClFN4O and a molecular weight of 326.80 g/mol. Its IUPAC name is 1-[2-(4-aminopiperidin-1-yl)ethyl]-7-fluoro-1,5-naphthyridin-2-one;hydrochloride.

Molecular Properties

Compound Name1-[2-(4-aminopiperidin-1-yl)ethyl]-7-fluoro-1,5-naphthyridin-2-one;hydrochloride
PubChem CID68927113
Molecular FormulaC15H20ClFN4O
Molecular Weight326.80 g/mol
Exact Mass326.13
IUPAC Name1-[2-(4-aminopiperidin-1-yl)ethyl]-7-fluoro-1,5-naphthyridin-2-one;hydrochloride
SMILESCl.NC1CCN(CCn2c(=O)ccc3ncc(F)cc32)CC1
InChIInChI=1S/C15H19FN4O.ClH/c16-11-9-14-13(18-10-11)1-2-15(21)20(14)8-7-19-5-3-12(17)4-6-19;/h1-2,9-10,12H,3-8,17H2;1H
InChIKeyVGIJDAFEQOIGBO-UHFFFAOYSA-N
XLogP1.38
TPSA64.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.80
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(4-aminopiperidin-1-yl)ethyl]-7-fluoro-1,5-naphthyridin-2-one;hydrochloride?
The IUPAC name of 1-[2-(4-aminopiperidin-1-yl)ethyl]-7-fluoro-1,5-naphthyridin-2-one;hydrochloride (CID 68927113) is 1-[2-(4-aminopiperidin-1-yl)ethyl]-7-fluoro-1,5-naphthyridin-2-one;hydrochloride.
What is the SMILES notation for 1-[2-(4-aminopiperidin-1-yl)ethyl]-7-fluoro-1,5-naphthyridin-2-one;hydrochloride?
The canonical SMILES for 1-[2-(4-aminopiperidin-1-yl)ethyl]-7-fluoro-1,5-naphthyridin-2-one;hydrochloride is Cl.NC1CCN(CCn2c(=O)ccc3ncc(F)cc32)CC1.
What is the InChIKey of 1-[2-(4-aminopiperidin-1-yl)ethyl]-7-fluoro-1,5-naphthyridin-2-one;hydrochloride?
The InChIKey is VGIJDAFEQOIGBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19FN4O.ClH/c16-11-9-14-13(18-10-11)1-2-15(21)20(14)8-7-19-5-3-12(17)4-6-19;/h1-2,9-10,12H,3-8,17H2;1H.
What are the key properties of 1-[2-(4-aminopiperidin-1-yl)ethyl]-7-fluoro-1,5-naphthyridin-2-one;hydrochloride?
1-[2-(4-aminopiperidin-1-yl)ethyl]-7-fluoro-1,5-naphthyridin-2-one;hydrochloride has a molecular weight of 326.80 g/mol, XLogP of 1.38, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(4-aminopiperidin-1-yl)ethyl]-7-fluoro-1,5-naphthyridin-2-one;hydrochloride is sourced from PubChem (CID 68927113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).