5-chloro-8-(sulfamoylamino)quinoline

C9H8ClN3O2S — CID 112573673

IUPAC5-chloro-8-(sulfamoylamino)quinoline
SMILESNS(=O)(=O)Nc1ccc(Cl)c2cccnc12
InChIInChI=1S/C9H8ClN3O2S/c10-7-3-4-8(13-16(11,14)15)9-6(7)2-1-5-12-9/h1-5,13H,(H2,11,14,15)
InChIKeyKZJMBDPLEIIEER-UHFFFAOYSA-N
MW257.70 g/mol
LogP1.50
Rot. Bonds2

About 5-chloro-8-(sulfamoylamino)quinoline

5-chloro-8-(sulfamoylamino)quinoline (PubChem CID 112573673) has the molecular formula C9H8ClN3O2S and a molecular weight of 257.70 g/mol. Its IUPAC name is 5-chloro-8-(sulfamoylamino)quinoline.

Molecular Properties

Compound Name5-chloro-8-(sulfamoylamino)quinoline
PubChem CID112573673
Molecular FormulaC9H8ClN3O2S
Molecular Weight257.70 g/mol
Exact Mass257.00
IUPAC Name5-chloro-8-(sulfamoylamino)quinoline
SMILESNS(=O)(=O)Nc1ccc(Cl)c2cccnc12
InChIInChI=1S/C9H8ClN3O2S/c10-7-3-4-8(13-16(11,14)15)9-6(7)2-1-5-12-9/h1-5,13H,(H2,11,14,15)
InChIKeyKZJMBDPLEIIEER-UHFFFAOYSA-N
XLogP1.50
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.70
LogP ≤ 51.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(5-chloroquinolin-8-yl)amino]ethanesulfonamide
CID 114384833
N-(5-chloroquinolin-8-yl)piperazine-1-sulfonamide
CID 61253332
5-chloro-N-(2-ethylsulfonylethyl)quinolin-8-amine
CID 116783967
5-chloroquinoline-8-sulfonyl chloride
CID 4206949
2-[(5-chloroquinolin-8-yl)amino]acetic acid
CID 116783965
N-(8-chloroquinolin-5-yl)-1H-pyrazole-5-sulfonamide
CID 102692686
3-amino-N-(5-chloroquinolin-8-yl)-2,2,3-trimethylbutanamide
CID 65269986
2-N-(5-chloroquinolin-8-yl)pyrimidine-2,4-diamine
CID 116797540
2-[(5-chloroquinolin-8-yl)amino]propanoic acid
CID 66172326
CID 172791001
CID 172791001
2-amino-N-[2-[(5-chloroquinolin-8-yl)amino]-2-oxoethyl]acetamide
CID 60928298
1-(5-chloroquinolin-8-yl)-2,2,2-trifluoroethanesulfonamide
CID 114827717

Frequently Asked Questions

What is the IUPAC name of 5-chloro-8-(sulfamoylamino)quinoline?
The IUPAC name of 5-chloro-8-(sulfamoylamino)quinoline (CID 112573673) is 5-chloro-8-(sulfamoylamino)quinoline.
What is the SMILES notation for 5-chloro-8-(sulfamoylamino)quinoline?
The canonical SMILES for 5-chloro-8-(sulfamoylamino)quinoline is NS(=O)(=O)Nc1ccc(Cl)c2cccnc12.
What is the InChIKey of 5-chloro-8-(sulfamoylamino)quinoline?
The InChIKey is KZJMBDPLEIIEER-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8ClN3O2S/c10-7-3-4-8(13-16(11,14)15)9-6(7)2-1-5-12-9/h1-5,13H,(H2,11,14,15).
What are the key properties of 5-chloro-8-(sulfamoylamino)quinoline?
5-chloro-8-(sulfamoylamino)quinoline has a molecular weight of 257.70 g/mol, XLogP of 1.50, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-8-(sulfamoylamino)quinoline is sourced from PubChem (CID 112573673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).