2-chloro-N-[2-(dimethylamino)propyl]imidazo[1,2-a]pyridine-3-sulfonamide

C12H17ClN4O2S — CID 61045081

IUPAC2-chloro-N-[2-(dimethylamino)propyl]imidazo[1,2-a]pyridine-3-sulfonamide
SMILESCC(CNS(=O)(=O)c1c(Cl)nc2ccccn12)N(C)C
InChIInChI=1S/C12H17ClN4O2S/c1-9(16(2)3)8-14-20(18,19)12-11(13)15-10-6-4-5-7-17(10)12/h4-7,9,14H,8H2,1-3H3
InChIKeyRDGJOFCTCCISPN-UHFFFAOYSA-N
MW316.81 g/mol
LogP1.22
Rot. Bonds5

About 2-chloro-N-[2-(dimethylamino)propyl]imidazo[1,2-a]pyridine-3-sulfonamide

2-chloro-N-[2-(dimethylamino)propyl]imidazo[1,2-a]pyridine-3-sulfonamide (PubChem CID 61045081) has the molecular formula C12H17ClN4O2S and a molecular weight of 316.81 g/mol. Its IUPAC name is 2-chloro-N-[2-(dimethylamino)propyl]imidazo[1,2-a]pyridine-3-sulfonamide.

Molecular Properties

Compound Name2-chloro-N-[2-(dimethylamino)propyl]imidazo[1,2-a]pyridine-3-sulfonamide
PubChem CID61045081
Molecular FormulaC12H17ClN4O2S
Molecular Weight316.81 g/mol
Exact Mass316.08
IUPAC Name2-chloro-N-[2-(dimethylamino)propyl]imidazo[1,2-a]pyridine-3-sulfonamide
SMILESCC(CNS(=O)(=O)c1c(Cl)nc2ccccn12)N(C)C
InChIInChI=1S/C12H17ClN4O2S/c1-9(16(2)3)8-14-20(18,19)12-11(13)15-10-6-4-5-7-17(10)12/h4-7,9,14H,8H2,1-3H3
InChIKeyRDGJOFCTCCISPN-UHFFFAOYSA-N
XLogP1.22
TPSA66.71 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.81
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(Ethanesulfonyl)imidazo(1,2-a)pyridine-3-sulfonamide
CID 15477602
(2-Ethylsulfonylimidazo[1,2-a]pyridin-3-yl)sulfonylurea
CID 91103679
Ulfosulfuron guanidine
CID 101134254
Sulfonylbiuret
CID 139594334
4-chloro-N-[1-(1-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]benzenesulfonamide
CID 59177064
N-((8-methylimidazo[1,2-a]pyridin-2-yl)methyl)propane-1-sulfonamide
CID 3238358
4-chloro-N-[1-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]benzenesulfonamide
CID 59177167
2-Chloroimidazo[1,2-a]pyridine-3-sulfonamide
CID 14422354
Imidazo(1,2-a)pyridine-3-sulfonamide
CID 14422439
Imidazo[1,2-a]pyridine-3-sulfonyl chloride
CID 53256697
Imidazo(1,2-a)pyridine-8-sulfonyl chloride
CID 83821677
Imidazo[1,2-a]pyridine-2-sulfonyl chloride
CID 121420066

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[2-(dimethylamino)propyl]imidazo[1,2-a]pyridine-3-sulfonamide?
The IUPAC name of 2-chloro-N-[2-(dimethylamino)propyl]imidazo[1,2-a]pyridine-3-sulfonamide (CID 61045081) is 2-chloro-N-[2-(dimethylamino)propyl]imidazo[1,2-a]pyridine-3-sulfonamide.
What is the SMILES notation for 2-chloro-N-[2-(dimethylamino)propyl]imidazo[1,2-a]pyridine-3-sulfonamide?
The canonical SMILES for 2-chloro-N-[2-(dimethylamino)propyl]imidazo[1,2-a]pyridine-3-sulfonamide is CC(CNS(=O)(=O)c1c(Cl)nc2ccccn12)N(C)C.
What is the InChIKey of 2-chloro-N-[2-(dimethylamino)propyl]imidazo[1,2-a]pyridine-3-sulfonamide?
The InChIKey is RDGJOFCTCCISPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17ClN4O2S/c1-9(16(2)3)8-14-20(18,19)12-11(13)15-10-6-4-5-7-17(10)12/h4-7,9,14H,8H2,1-3H3.
What are the key properties of 2-chloro-N-[2-(dimethylamino)propyl]imidazo[1,2-a]pyridine-3-sulfonamide?
2-chloro-N-[2-(dimethylamino)propyl]imidazo[1,2-a]pyridine-3-sulfonamide has a molecular weight of 316.81 g/mol, XLogP of 1.22, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[2-(dimethylamino)propyl]imidazo[1,2-a]pyridine-3-sulfonamide is sourced from PubChem (CID 61045081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).