5-chloro-N-ethyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-2-methylbenzenesulfonamide

C17H18ClN3O2S — CID 90570746

IUPAC5-chloro-N-ethyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-2-methylbenzenesulfonamide
SMILESCCN(Cc1cnc2ccccn12)S(=O)(=O)c1cc(Cl)ccc1C
InChIInChI=1S/C17H18ClN3O2S/c1-3-20(12-15-11-19-17-6-4-5-9-21(15)17)24(22,23)16-10-14(18)8-7-13(16)2/h4-11H,3,12H2,1-2H3
InChIKeyGXDJJYPETHVTHI-UHFFFAOYSA-N
MW363.87 g/mol
LogP3.51
Rot. Bonds5

About 5-chloro-N-ethyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-2-methylbenzenesulfonamide

5-chloro-N-ethyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-2-methylbenzenesulfonamide (PubChem CID 90570746) has the molecular formula C17H18ClN3O2S and a molecular weight of 363.87 g/mol. Its IUPAC name is 5-chloro-N-ethyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-2-methylbenzenesulfonamide.

Molecular Properties

Compound Name5-chloro-N-ethyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-2-methylbenzenesulfonamide
PubChem CID90570746
Molecular FormulaC17H18ClN3O2S
Molecular Weight363.87 g/mol
Exact Mass363.08
IUPAC Name5-chloro-N-ethyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-2-methylbenzenesulfonamide
SMILESCCN(Cc1cnc2ccccn12)S(=O)(=O)c1cc(Cl)ccc1C
InChIInChI=1S/C17H18ClN3O2S/c1-3-20(12-15-11-19-17-6-4-5-9-21(15)17)24(22,23)16-10-14(18)8-7-13(16)2/h4-11H,3,12H2,1-2H3
InChIKeyGXDJJYPETHVTHI-UHFFFAOYSA-N
XLogP3.51
TPSA54.68 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.87
LogP ≤ 53.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N,4-diethyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)benzenesulfonamide
CID 90570761
3-acetyl-N-ethyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)benzenesulfonamide
CID 90570747
N-(imidazo[1,2-a]pyridin-3-ylmethyl)-3,4-dimethyl-N-phenylbenzenesulfonamide
CID 90570380
N-ethyl-1-(4-fluorophenyl)-N-(imidazo[1,2-a]pyridin-3-ylmethyl)methanesulfonamide
CID 90570764
methyl 2-[(5-chloro-2-methylphenyl)sulfonyl-ethylamino]acetate
CID 54979246
N-cyclopropyl-2,5-difluoro-N-(imidazo[1,2-a]pyridin-3-ylmethyl)benzenesulfonamide
CID 90570067
N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-(2-methylsulfonylethyl)propan-2-amine
CID 75433712
9-chloro-N,N-diethyl-6-oxopyrido[1,2-a]quinazoline-8-sulfonamide
CID 5302217
N-cyclopropyl-2,4-difluoro-N-(imidazo[1,2-a]pyridin-3-ylmethyl)benzenesulfonamide
CID 90570047
N,2-diethyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)butanamide
CID 90570483
N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-phenylpyridine-3-sulfonamide
CID 90570374
N-cyclopropyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)benzenesulfonamide
CID 90570029

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-ethyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-2-methylbenzenesulfonamide?
The IUPAC name of 5-chloro-N-ethyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-2-methylbenzenesulfonamide (CID 90570746) is 5-chloro-N-ethyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-2-methylbenzenesulfonamide.
What is the SMILES notation for 5-chloro-N-ethyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-2-methylbenzenesulfonamide?
The canonical SMILES for 5-chloro-N-ethyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-2-methylbenzenesulfonamide is CCN(Cc1cnc2ccccn12)S(=O)(=O)c1cc(Cl)ccc1C.
What is the InChIKey of 5-chloro-N-ethyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-2-methylbenzenesulfonamide?
The InChIKey is GXDJJYPETHVTHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18ClN3O2S/c1-3-20(12-15-11-19-17-6-4-5-9-21(15)17)24(22,23)16-10-14(18)8-7-13(16)2/h4-11H,3,12H2,1-2H3.
What are the key properties of 5-chloro-N-ethyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-2-methylbenzenesulfonamide?
5-chloro-N-ethyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-2-methylbenzenesulfonamide has a molecular weight of 363.87 g/mol, XLogP of 3.51, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-ethyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-2-methylbenzenesulfonamide is sourced from PubChem (CID 90570746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).