N-(2,3-dimethylimidazo[1,2-a]pyridin-6-yl)-1-phenylmethanesulfonamide

C16H17N3O2S — CID 110735017

IUPACN-(2,3-dimethylimidazo[1,2-a]pyridin-6-yl)-1-phenylmethanesulfonamide
SMILESCc1nc2ccc(NS(=O)(=O)Cc3ccccc3)cn2c1C
InChIInChI=1S/C16H17N3O2S/c1-12-13(2)19-10-15(8-9-16(19)17-12)18-22(20,21)11-14-6-4-3-5-7-14/h3-10,18H,11H2,1-2H3
InChIKeyIOOZBTLTMHKWIZ-UHFFFAOYSA-N
MW315.40 g/mol
LogP2.89
Rot. Bonds4

About N-(2,3-dimethylimidazo[1,2-a]pyridin-6-yl)-1-phenylmethanesulfonamide

N-(2,3-dimethylimidazo[1,2-a]pyridin-6-yl)-1-phenylmethanesulfonamide (PubChem CID 110735017) has the molecular formula C16H17N3O2S and a molecular weight of 315.40 g/mol. Its IUPAC name is N-(2,3-dimethylimidazo[1,2-a]pyridin-6-yl)-1-phenylmethanesulfonamide.

Molecular Properties

Compound NameN-(2,3-dimethylimidazo[1,2-a]pyridin-6-yl)-1-phenylmethanesulfonamide
PubChem CID110735017
Molecular FormulaC16H17N3O2S
Molecular Weight315.40 g/mol
Exact Mass315.10
IUPAC NameN-(2,3-dimethylimidazo[1,2-a]pyridin-6-yl)-1-phenylmethanesulfonamide
SMILESCc1nc2ccc(NS(=O)(=O)Cc3ccccc3)cn2c1C
InChIInChI=1S/C16H17N3O2S/c1-12-13(2)19-10-15(8-9-16(19)17-12)18-22(20,21)11-14-6-4-3-5-7-14/h3-10,18H,11H2,1-2H3
InChIKeyIOOZBTLTMHKWIZ-UHFFFAOYSA-N
XLogP2.89
TPSA63.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.40
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

benzyl N-(2,3-dimethylimidazo[1,2-a]pyridin-6-yl)carbamate
CID 110734959
N-(2,3-dimethylimidazo[1,2-a]pyridin-6-yl)-3-methylbenzenesulfonamide
CID 110735015
N-[4-(3-methylpyrazol-1-yl)phenyl]-1-phenylmethanesulfonamide
CID 35521142
N-[4-(benzylsulfonylamino)phenyl]acetamide
CID 743927
N-(3-bromo-4-methylphenyl)-1-phenylmethanesulfonamide
CID 55202713
N-[4-(3,5-dimethyl-1,2-oxazol-4-yl)phenyl]-1-phenylmethanesulfonamide
CID 110669901
N-(4-cyanophenyl)-1-phenylmethanesulfonamide
CID 798666
N-(4-phenoxyphenyl)-1-phenylmethanesulfonamide
CID 8512912
1-(4-chlorophenyl)-N-(2,3-dimethylimidazo[1,2-a]pyridin-8-yl)methanesulfonamide
CID 110735475
N-(4-methoxy-3-methylphenyl)-1-phenylmethanesulfonamide
CID 110776446
N-[3-(4-anilinoanilino)phenyl]-1-phenylmethanesulfonamide
CID 67859373
N-(6-chloro-5-methyl-3-pyridinyl)-1-phenylmethanesulfonamide
CID 103868547

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethylimidazo[1,2-a]pyridin-6-yl)-1-phenylmethanesulfonamide?
The IUPAC name of N-(2,3-dimethylimidazo[1,2-a]pyridin-6-yl)-1-phenylmethanesulfonamide (CID 110735017) is N-(2,3-dimethylimidazo[1,2-a]pyridin-6-yl)-1-phenylmethanesulfonamide.
What is the SMILES notation for N-(2,3-dimethylimidazo[1,2-a]pyridin-6-yl)-1-phenylmethanesulfonamide?
The canonical SMILES for N-(2,3-dimethylimidazo[1,2-a]pyridin-6-yl)-1-phenylmethanesulfonamide is Cc1nc2ccc(NS(=O)(=O)Cc3ccccc3)cn2c1C.
What is the InChIKey of N-(2,3-dimethylimidazo[1,2-a]pyridin-6-yl)-1-phenylmethanesulfonamide?
The InChIKey is IOOZBTLTMHKWIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O2S/c1-12-13(2)19-10-15(8-9-16(19)17-12)18-22(20,21)11-14-6-4-3-5-7-14/h3-10,18H,11H2,1-2H3.
What are the key properties of N-(2,3-dimethylimidazo[1,2-a]pyridin-6-yl)-1-phenylmethanesulfonamide?
N-(2,3-dimethylimidazo[1,2-a]pyridin-6-yl)-1-phenylmethanesulfonamide has a molecular weight of 315.40 g/mol, XLogP of 2.89, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethylimidazo[1,2-a]pyridin-6-yl)-1-phenylmethanesulfonamide is sourced from PubChem (CID 110735017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).