6-[3-(3-methylazetidin-1-yl)propyl]-1,5,7,8-tetrahydro-1,6-naphthyridin-4-one

C15H23N3O — CID 176924730

IUPAC6-[3-(3-methylazetidin-1-yl)propyl]-1,5,7,8-tetrahydro-1,6-naphthyridin-4-one
SMILESCC1CN(CCCN2CCc3[nH]ccc(=O)c3C2)C1
InChIInChI=1S/C15H23N3O/c1-12-9-18(10-12)7-2-6-17-8-4-14-13(11-17)15(19)3-5-16-14/h3,5,12H,2,4,6-11H2,1H3,(H,16,19)
InChIKeySJKMJZXCKGZSRB-UHFFFAOYSA-N
MW261.37 g/mol
LogP1.07
Rot. Bonds4

About 6-[3-(3-methylazetidin-1-yl)propyl]-1,5,7,8-tetrahydro-1,6-naphthyridin-4-one

6-[3-(3-methylazetidin-1-yl)propyl]-1,5,7,8-tetrahydro-1,6-naphthyridin-4-one (PubChem CID 176924730) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is 6-[3-(3-methylazetidin-1-yl)propyl]-1,5,7,8-tetrahydro-1,6-naphthyridin-4-one.

Molecular Properties

Compound Name6-[3-(3-methylazetidin-1-yl)propyl]-1,5,7,8-tetrahydro-1,6-naphthyridin-4-one
PubChem CID176924730
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC Name6-[3-(3-methylazetidin-1-yl)propyl]-1,5,7,8-tetrahydro-1,6-naphthyridin-4-one
SMILESCC1CN(CCCN2CCc3[nH]ccc(=O)c3C2)C1
InChIInChI=1S/C15H23N3O/c1-12-9-18(10-12)7-2-6-17-8-4-14-13(11-17)15(19)3-5-16-14/h3,5,12H,2,4,6-11H2,1H3,(H,16,19)
InChIKeySJKMJZXCKGZSRB-UHFFFAOYSA-N
XLogP1.07
TPSA39.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-[3-(3-methylazetidin-1-yl)propyl]-1,5,7,8-tetrahydro-1,6-naphthyridin-4-one with MolForge

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Related Compounds

methane;6-[2-(1-methylazetidin-3-yl)ethyl]-1,5,7,8-tetrahydro-1,6-naphthyridin-4-one
CID 176923857
6-(2-morpholin-4-ylethyl)-1,5,7,8-tetrahydro-1,6-naphthyridin-4-one
CID 176924206
6-[(3-ethyl-5-methyltriazol-4-yl)methyl]-1,5,7,8-tetrahydro-1,6-naphthyridin-4-one
CID 167809814
1-[3-(3-methylazetidin-1-yl)propyl]piperazine
CID 79677275
N-[3-(4-methylpiperidin-1-yl)propyl]-6-oxo-1H-pyridine-3-sulfonamide
CID 43629431
6-(4-hydroxybutyl)-3-methyl-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidine-2,4-dione
CID 19423338
6-(2-piperidin-4-ylethyl)-2,5,7,8-tetrahydro-2,6-naphthyridin-1-one
CID 167943100
5-methyl-1,4,6,7-tetrahydropyrrolo[3,2-c]pyridine
CID 70258346
N-[3-[(3R,5R)-3,5-dimethylpiperidin-1-yl]propyl]-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide
CID 94019456
N-[3-[(3S,5S)-3,5-dimethylpiperidin-1-yl]propyl]-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide
CID 94019455
4-[3-(3-methylpiperidin-1-yl)propyl]-2,3-dihydro-1H-pyridin-6-one
CID 135202248
2,5-dimethyl-N-[3-[(3S)-3-methylpiperidin-1-yl]propyl]benzenesulfonamide
CID 94061337

Frequently Asked Questions

What is the IUPAC name of 6-[3-(3-methylazetidin-1-yl)propyl]-1,5,7,8-tetrahydro-1,6-naphthyridin-4-one?
The IUPAC name of 6-[3-(3-methylazetidin-1-yl)propyl]-1,5,7,8-tetrahydro-1,6-naphthyridin-4-one (CID 176924730) is 6-[3-(3-methylazetidin-1-yl)propyl]-1,5,7,8-tetrahydro-1,6-naphthyridin-4-one.
What is the SMILES notation for 6-[3-(3-methylazetidin-1-yl)propyl]-1,5,7,8-tetrahydro-1,6-naphthyridin-4-one?
The canonical SMILES for 6-[3-(3-methylazetidin-1-yl)propyl]-1,5,7,8-tetrahydro-1,6-naphthyridin-4-one is CC1CN(CCCN2CCc3[nH]ccc(=O)c3C2)C1.
What is the InChIKey of 6-[3-(3-methylazetidin-1-yl)propyl]-1,5,7,8-tetrahydro-1,6-naphthyridin-4-one?
The InChIKey is SJKMJZXCKGZSRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-12-9-18(10-12)7-2-6-17-8-4-14-13(11-17)15(19)3-5-16-14/h3,5,12H,2,4,6-11H2,1H3,(H,16,19).
What are the key properties of 6-[3-(3-methylazetidin-1-yl)propyl]-1,5,7,8-tetrahydro-1,6-naphthyridin-4-one?
6-[3-(3-methylazetidin-1-yl)propyl]-1,5,7,8-tetrahydro-1,6-naphthyridin-4-one has a molecular weight of 261.37 g/mol, XLogP of 1.07, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[3-(3-methylazetidin-1-yl)propyl]-1,5,7,8-tetrahydro-1,6-naphthyridin-4-one is sourced from PubChem (CID 176924730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).