6-amino-5-chloro-N-(1-cyclopropylethyl)pyridine-3-sulfonamide

C10H14ClN3O2S — CID 64609097

IUPAC6-amino-5-chloro-N-(1-cyclopropylethyl)pyridine-3-sulfonamide
SMILESCC(NS(=O)(=O)c1cnc(N)c(Cl)c1)C1CC1
InChIInChI=1S/C10H14ClN3O2S/c1-6(7-2-3-7)14-17(15,16)8-4-9(11)10(12)13-5-8/h4-7,14H,2-3H2,1H3,(H2,12,13)
InChIKeyKEWHWIBVXDANKH-UHFFFAOYSA-N
MW275.76 g/mol
LogP1.39
Rot. Bonds4

About 6-amino-5-chloro-N-(1-cyclopropylethyl)pyridine-3-sulfonamide

6-amino-5-chloro-N-(1-cyclopropylethyl)pyridine-3-sulfonamide (PubChem CID 64609097) has the molecular formula C10H14ClN3O2S and a molecular weight of 275.76 g/mol. Its IUPAC name is 6-amino-5-chloro-N-(1-cyclopropylethyl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name6-amino-5-chloro-N-(1-cyclopropylethyl)pyridine-3-sulfonamide
PubChem CID64609097
Molecular FormulaC10H14ClN3O2S
Molecular Weight275.76 g/mol
Exact Mass275.05
IUPAC Name6-amino-5-chloro-N-(1-cyclopropylethyl)pyridine-3-sulfonamide
SMILESCC(NS(=O)(=O)c1cnc(N)c(Cl)c1)C1CC1
InChIInChI=1S/C10H14ClN3O2S/c1-6(7-2-3-7)14-17(15,16)8-4-9(11)10(12)13-5-8/h4-7,14H,2-3H2,1H3,(H2,12,13)
InChIKeyKEWHWIBVXDANKH-UHFFFAOYSA-N
XLogP1.39
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.76
LogP ≤ 51.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-amino-5-chloro-N-(1-cyclopropylethyl)pyridine-3-sulfonamide?
The IUPAC name of 6-amino-5-chloro-N-(1-cyclopropylethyl)pyridine-3-sulfonamide (CID 64609097) is 6-amino-5-chloro-N-(1-cyclopropylethyl)pyridine-3-sulfonamide.
What is the SMILES notation for 6-amino-5-chloro-N-(1-cyclopropylethyl)pyridine-3-sulfonamide?
The canonical SMILES for 6-amino-5-chloro-N-(1-cyclopropylethyl)pyridine-3-sulfonamide is CC(NS(=O)(=O)c1cnc(N)c(Cl)c1)C1CC1.
What is the InChIKey of 6-amino-5-chloro-N-(1-cyclopropylethyl)pyridine-3-sulfonamide?
The InChIKey is KEWHWIBVXDANKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14ClN3O2S/c1-6(7-2-3-7)14-17(15,16)8-4-9(11)10(12)13-5-8/h4-7,14H,2-3H2,1H3,(H2,12,13).
What are the key properties of 6-amino-5-chloro-N-(1-cyclopropylethyl)pyridine-3-sulfonamide?
6-amino-5-chloro-N-(1-cyclopropylethyl)pyridine-3-sulfonamide has a molecular weight of 275.76 g/mol, XLogP of 1.39, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-5-chloro-N-(1-cyclopropylethyl)pyridine-3-sulfonamide is sourced from PubChem (CID 64609097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).