2-amino-5-chloro-N-[2-(methylamino)propyl]pyridine-3-sulfonamide

C9H15ClN4O2S — CID 120824575

IUPAC2-amino-5-chloro-N-[2-(methylamino)propyl]pyridine-3-sulfonamide
SMILESCNC(C)CNS(=O)(=O)c1cc(Cl)cnc1N
InChIInChI=1S/C9H15ClN4O2S/c1-6(12-2)4-14-17(15,16)8-3-7(10)5-13-9(8)11/h3,5-6,12,14H,4H2,1-2H3,(H2,11,13)
InChIKeyINRWSPPOOTZLPY-UHFFFAOYSA-N
MW278.76 g/mol
LogP0.20
Rot. Bonds5

About 2-amino-5-chloro-N-[2-(methylamino)propyl]pyridine-3-sulfonamide

2-amino-5-chloro-N-[2-(methylamino)propyl]pyridine-3-sulfonamide (PubChem CID 120824575) has the molecular formula C9H15ClN4O2S and a molecular weight of 278.76 g/mol. Its IUPAC name is 2-amino-5-chloro-N-[2-(methylamino)propyl]pyridine-3-sulfonamide.

Molecular Properties

Compound Name2-amino-5-chloro-N-[2-(methylamino)propyl]pyridine-3-sulfonamide
PubChem CID120824575
Molecular FormulaC9H15ClN4O2S
Molecular Weight278.76 g/mol
Exact Mass278.06
IUPAC Name2-amino-5-chloro-N-[2-(methylamino)propyl]pyridine-3-sulfonamide
SMILESCNC(C)CNS(=O)(=O)c1cc(Cl)cnc1N
InChIInChI=1S/C9H15ClN4O2S/c1-6(12-2)4-14-17(15,16)8-3-7(10)5-13-9(8)11/h3,5-6,12,14H,4H2,1-2H3,(H2,11,13)
InChIKeyINRWSPPOOTZLPY-UHFFFAOYSA-N
XLogP0.20
TPSA97.11 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.76
LogP ≤ 50.20
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

4-chloro-N-(pyridin-2-yl)benzenesulfonamide
CID 224199
4-Chloro-N-(5-chloro-2-pyridinyl)benzenesulfonamide
CID 616967
N-(5-chloropyridin-2-yl)benzenesulfonamide
CID 555746
N-(5-chloropyridin-2-yl)-4-fluorobenzenesulfonamide
CID 794044
2-Amino-5-chloro-pyridine-3-sulfonic acid amide
CID 2779673
N-(tert-butyl)-5,6-dichloro-3-pyridinesulfonamide
CID 826903
4-chloro-N-(4-chloro-2-pyridinyl)benzenesulfonamide
CID 898366
2-(3-Chloroanilino)-3-pyridinesulfonamide
CID 902008
N,N-diisopropyl-6-(propylamino)-3-pyridinesulfonamide
CID 1741689
3,5-dichloro-N-(5-methyl-4,5-dihydro-1H-imidazol-2-yl)pyridin-2-amine;hydrochloride
CID 44523105
6-chloro-N-(4-methylpyridin-2-yl)pyridine-3-sulfonamide
CID 3678077
7-chloro-N-(3-methylbutan-2-yl)-1,1-dioxo-4H-pyrido[2,3-e][1,2,4]thiadiazin-3-imine
CID 135456758

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-chloro-N-[2-(methylamino)propyl]pyridine-3-sulfonamide?
The IUPAC name of 2-amino-5-chloro-N-[2-(methylamino)propyl]pyridine-3-sulfonamide (CID 120824575) is 2-amino-5-chloro-N-[2-(methylamino)propyl]pyridine-3-sulfonamide.
What is the SMILES notation for 2-amino-5-chloro-N-[2-(methylamino)propyl]pyridine-3-sulfonamide?
The canonical SMILES for 2-amino-5-chloro-N-[2-(methylamino)propyl]pyridine-3-sulfonamide is CNC(C)CNS(=O)(=O)c1cc(Cl)cnc1N.
What is the InChIKey of 2-amino-5-chloro-N-[2-(methylamino)propyl]pyridine-3-sulfonamide?
The InChIKey is INRWSPPOOTZLPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15ClN4O2S/c1-6(12-2)4-14-17(15,16)8-3-7(10)5-13-9(8)11/h3,5-6,12,14H,4H2,1-2H3,(H2,11,13).
What are the key properties of 2-amino-5-chloro-N-[2-(methylamino)propyl]pyridine-3-sulfonamide?
2-amino-5-chloro-N-[2-(methylamino)propyl]pyridine-3-sulfonamide has a molecular weight of 278.76 g/mol, XLogP of 0.20, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-chloro-N-[2-(methylamino)propyl]pyridine-3-sulfonamide is sourced from PubChem (CID 120824575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).