N,4-diethyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)benzenesulfonamide

C18H21N3O2S — CID 90570761

IUPACN,4-diethyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)benzenesulfonamide
SMILESCCc1ccc(S(=O)(=O)N(CC)Cc2cnc3ccccn23)cc1
InChIInChI=1S/C18H21N3O2S/c1-3-15-8-10-17(11-9-15)24(22,23)20(4-2)14-16-13-19-18-7-5-6-12-21(16)18/h5-13H,3-4,14H2,1-2H3
InChIKeyWLTLWRUIQOREQN-UHFFFAOYSA-N
MW343.45 g/mol
LogP3.11
Rot. Bonds6

About N,4-diethyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)benzenesulfonamide

N,4-diethyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)benzenesulfonamide (PubChem CID 90570761) has the molecular formula C18H21N3O2S and a molecular weight of 343.45 g/mol. Its IUPAC name is N,4-diethyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)benzenesulfonamide.

Molecular Properties

Compound NameN,4-diethyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)benzenesulfonamide
PubChem CID90570761
Molecular FormulaC18H21N3O2S
Molecular Weight343.45 g/mol
Exact Mass343.14
IUPAC NameN,4-diethyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)benzenesulfonamide
SMILESCCc1ccc(S(=O)(=O)N(CC)Cc2cnc3ccccn23)cc1
InChIInChI=1S/C18H21N3O2S/c1-3-15-8-10-17(11-9-15)24(22,23)20(4-2)14-16-13-19-18-7-5-6-12-21(16)18/h5-13H,3-4,14H2,1-2H3
InChIKeyWLTLWRUIQOREQN-UHFFFAOYSA-N
XLogP3.11
TPSA54.68 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.45
LogP ≤ 53.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3-acetyl-N-ethyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)benzenesulfonamide
CID 90570747
N-ethyl-1-(4-fluorophenyl)-N-(imidazo[1,2-a]pyridin-3-ylmethyl)methanesulfonamide
CID 90570764
5-chloro-N-ethyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-2-methylbenzenesulfonamide
CID 90570746
5-ethyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-methylpyrimidin-2-amine
CID 72874865
N-(imidazo[1,2-a]pyridin-3-ylmethyl)-3,4-dimethyl-N-phenylbenzenesulfonamide
CID 90570380
N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-phenylpyridine-3-sulfonamide
CID 90570374
N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-(2-methylsulfonylethyl)propan-2-amine
CID 75433712
1-ethyl-1-(imidazo[1,2-a]pyridin-3-ylmethyl)-3-[(4-methoxyphenyl)methyl]urea
CID 71802043
N-[(3,4-dimethoxyphenyl)methyl]-N,4-diethylbenzenesulfonamide
CID 8801363
N-(imidazo[1,2-a]pyridin-3-ylmethyl)-N-methyl-3-methylsulfonylpropanamide
CID 131897855
N-cyclopropyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)propane-2-sulfonamide
CID 90570063
N-benzyl-N-ethylbenzenesulfonamide
CID 668950

Frequently Asked Questions

What is the IUPAC name of N,4-diethyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)benzenesulfonamide?
The IUPAC name of N,4-diethyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)benzenesulfonamide (CID 90570761) is N,4-diethyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)benzenesulfonamide.
What is the SMILES notation for N,4-diethyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)benzenesulfonamide?
The canonical SMILES for N,4-diethyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)benzenesulfonamide is CCc1ccc(S(=O)(=O)N(CC)Cc2cnc3ccccn23)cc1.
What is the InChIKey of N,4-diethyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)benzenesulfonamide?
The InChIKey is WLTLWRUIQOREQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O2S/c1-3-15-8-10-17(11-9-15)24(22,23)20(4-2)14-16-13-19-18-7-5-6-12-21(16)18/h5-13H,3-4,14H2,1-2H3.
What are the key properties of N,4-diethyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)benzenesulfonamide?
N,4-diethyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)benzenesulfonamide has a molecular weight of 343.45 g/mol, XLogP of 3.11, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-diethyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)benzenesulfonamide is sourced from PubChem (CID 90570761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).