N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]propane-1-sulfonamide

C12H17N3O2S — CID 22517221

IUPACN-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]propane-1-sulfonamide
SMILESCCCS(=O)(=O)NCc1cn2ccc(C)cc2n1
InChIInChI=1S/C12H17N3O2S/c1-3-6-18(16,17)13-8-11-9-15-5-4-10(2)7-12(15)14-11/h4-5,7,9,13H,3,6,8H2,1-2H3
InChIKeyUMKRSAWFISWNLB-UHFFFAOYSA-N
MW267.35 g/mol
LogP1.47
Rot. Bonds5

About N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]propane-1-sulfonamide

N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]propane-1-sulfonamide (PubChem CID 22517221) has the molecular formula C12H17N3O2S and a molecular weight of 267.35 g/mol. Its IUPAC name is N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]propane-1-sulfonamide.

Molecular Properties

Compound NameN-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]propane-1-sulfonamide
PubChem CID22517221
Molecular FormulaC12H17N3O2S
Molecular Weight267.35 g/mol
Exact Mass267.10
IUPAC NameN-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]propane-1-sulfonamide
SMILESCCCS(=O)(=O)NCc1cn2ccc(C)cc2n1
InChIInChI=1S/C12H17N3O2S/c1-3-6-18(16,17)13-8-11-9-15-5-4-10(2)7-12(15)14-11/h4-5,7,9,13H,3,6,8H2,1-2H3
InChIKeyUMKRSAWFISWNLB-UHFFFAOYSA-N
XLogP1.47
TPSA63.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.35
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]propane-1-sulfonamide?
The IUPAC name of N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]propane-1-sulfonamide (CID 22517221) is N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]propane-1-sulfonamide.
What is the SMILES notation for N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]propane-1-sulfonamide?
The canonical SMILES for N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]propane-1-sulfonamide is CCCS(=O)(=O)NCc1cn2ccc(C)cc2n1.
What is the InChIKey of N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]propane-1-sulfonamide?
The InChIKey is UMKRSAWFISWNLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O2S/c1-3-6-18(16,17)13-8-11-9-15-5-4-10(2)7-12(15)14-11/h4-5,7,9,13H,3,6,8H2,1-2H3.
What are the key properties of N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]propane-1-sulfonamide?
N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]propane-1-sulfonamide has a molecular weight of 267.35 g/mol, XLogP of 1.47, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]propane-1-sulfonamide is sourced from PubChem (CID 22517221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).