7-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-1,7-naphthyridin-8-one

C16H19N3O2 — CID 126837339

IUPAC7-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-1,7-naphthyridin-8-one
SMILESCC1CCN(C(=O)Cn2ccc3cccnc3c2=O)CC1
InChIInChI=1S/C16H19N3O2/c1-12-4-8-18(9-5-12)14(20)11-19-10-6-13-3-2-7-17-15(13)16(19)21/h2-3,6-7,10,12H,4-5,8-9,11H2,1H3
InChIKeyRHJXMEZMVYGBJZ-UHFFFAOYSA-N
MW285.35 g/mol
LogP1.65
Rot. Bonds2

About 7-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-1,7-naphthyridin-8-one

7-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-1,7-naphthyridin-8-one (PubChem CID 126837339) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is 7-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-1,7-naphthyridin-8-one.

Molecular Properties

Compound Name7-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-1,7-naphthyridin-8-one
PubChem CID126837339
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC Name7-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-1,7-naphthyridin-8-one
SMILESCC1CCN(C(=O)Cn2ccc3cccnc3c2=O)CC1
InChIInChI=1S/C16H19N3O2/c1-12-4-8-18(9-5-12)14(20)11-19-10-6-13-3-2-7-17-15(13)16(19)21/h2-3,6-7,10,12H,4-5,8-9,11H2,1H3
InChIKeyRHJXMEZMVYGBJZ-UHFFFAOYSA-N
XLogP1.65
TPSA55.20 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 51.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-3-pyrrolidin-1-ylsulfonylpyridin-2-one
CID 53161876
3-benzyl-6-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]triazolo[4,5-d]pyrimidin-7-one
CID 7111068
1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-5-oxo-6-phenylmethoxyimidazo[1,2-a]pyrimidine-7-carboxylic acid
CID 58126984
1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-3-propan-2-ylimidazo[4,5-b]pyridin-2-one
CID 16668407
1-(4-methylpiperidin-1-yl)-2-quinolin-6-yloxyethanone
CID 112978586
2-[4-[2-(dimethylamino)pyrimidin-4-yl]piperazin-1-yl]-1-(4-methylpiperidin-1-yl)ethanone
CID 154829661
1-[4-[(S)-hydroxy(pyridin-2-yl)methyl]piperidin-1-yl]-2-indol-1-ylethanone
CID 124758560
1-[4-[(R)-hydroxy(pyridin-2-yl)methyl]piperidin-1-yl]-2-indol-1-ylethanone
CID 124758561
2-[2-oxo-2-[(4S)-4-phenylazepan-1-yl]ethyl]isoquinolin-1-one
CID 97269389
2-[2-(1,1-dioxo-1,4-thiazinan-4-yl)-2-oxoethyl]isoquinolin-1-one
CID 72886332
6-chloro-1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]quinolin-4-one
CID 100735436
2-indol-1-yl-1-(3-methylpiperidin-1-yl)ethanone
CID 110702436

Frequently Asked Questions

What is the IUPAC name of 7-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-1,7-naphthyridin-8-one?
The IUPAC name of 7-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-1,7-naphthyridin-8-one (CID 126837339) is 7-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-1,7-naphthyridin-8-one.
What is the SMILES notation for 7-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-1,7-naphthyridin-8-one?
The canonical SMILES for 7-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-1,7-naphthyridin-8-one is CC1CCN(C(=O)Cn2ccc3cccnc3c2=O)CC1.
What is the InChIKey of 7-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-1,7-naphthyridin-8-one?
The InChIKey is RHJXMEZMVYGBJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2/c1-12-4-8-18(9-5-12)14(20)11-19-10-6-13-3-2-7-17-15(13)16(19)21/h2-3,6-7,10,12H,4-5,8-9,11H2,1H3.
What are the key properties of 7-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-1,7-naphthyridin-8-one?
7-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-1,7-naphthyridin-8-one has a molecular weight of 285.35 g/mol, XLogP of 1.65, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-1,7-naphthyridin-8-one is sourced from PubChem (CID 126837339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).