2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethanesulfonamide

C10H15N3O2S — CID 69025708

IUPAC2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethanesulfonamide
SMILESNS(=O)(=O)CCc1ccc2c(n1)NCCC2
InChIInChI=1S/C10H15N3O2S/c11-16(14,15)7-5-9-4-3-8-2-1-6-12-10(8)13-9/h3-4H,1-2,5-7H2,(H,12,13)(H2,11,14,15)
InChIKeyOUNWTTRFZNYHEC-UHFFFAOYSA-N
MW241.32 g/mol
LogP0.27
Rot. Bonds3

About 2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethanesulfonamide

2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethanesulfonamide (PubChem CID 69025708) has the molecular formula C10H15N3O2S and a molecular weight of 241.32 g/mol. Its IUPAC name is 2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethanesulfonamide.

Molecular Properties

Compound Name2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethanesulfonamide
PubChem CID69025708
Molecular FormulaC10H15N3O2S
Molecular Weight241.32 g/mol
Exact Mass241.09
IUPAC Name2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethanesulfonamide
SMILESNS(=O)(=O)CCc1ccc2c(n1)NCCC2
InChIInChI=1S/C10H15N3O2S/c11-16(14,15)7-5-9-4-3-8-2-1-6-12-10(8)13-9/h3-4H,1-2,5-7H2,(H,12,13)(H2,11,14,15)
InChIKeyOUNWTTRFZNYHEC-UHFFFAOYSA-N
XLogP0.27
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.32
LogP ≤ 50.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethanamine;dihydrochloride
CID 22678213
2-(6,7,8,9-tetrahydro-5H-pyrido[2,3-b]azepin-2-yl)ethanol
CID 21054357
N-methyl-2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethanamine
CID 68525783
4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butanoic acid;trihydrochloride
CID 169448886
2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)acetic acid
CID 22570252
7-ethyl-1,2,3,4-tetrahydro-1,8-naphthyridine;molecular hydrogen
CID 176962671
2,6-difluoro-N-[2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethyl]benzenesulfonamide
CID 71590443
7-(2-ethylbutyl)-1,2,3,4-tetrahydro-1,8-naphthyridine
CID 177029071
N-ethyl-5-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)pentan-1-amine
CID 154031401
4-phenoxy-N-[2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethyl]benzenesulfonamide
CID 71590322
tert-butyl N-[2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethyl]carbamate
CID 54085210
1-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]piperidine-4-carboxamide
CID 175876666

Frequently Asked Questions

What is the IUPAC name of 2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethanesulfonamide?
The IUPAC name of 2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethanesulfonamide (CID 69025708) is 2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethanesulfonamide.
What is the SMILES notation for 2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethanesulfonamide?
The canonical SMILES for 2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethanesulfonamide is NS(=O)(=O)CCc1ccc2c(n1)NCCC2.
What is the InChIKey of 2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethanesulfonamide?
The InChIKey is OUNWTTRFZNYHEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2S/c11-16(14,15)7-5-9-4-3-8-2-1-6-12-10(8)13-9/h3-4H,1-2,5-7H2,(H,12,13)(H2,11,14,15).
What are the key properties of 2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethanesulfonamide?
2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethanesulfonamide has a molecular weight of 241.32 g/mol, XLogP of 0.27, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethanesulfonamide is sourced from PubChem (CID 69025708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).