N,N-dimethyl-4-[(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-ylsulfonylamino)methyl]benzamide

C17H22N4O3S — CID 139000833

IUPACN,N-dimethyl-4-[(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-ylsulfonylamino)methyl]benzamide
SMILESCN(C)C(=O)c1ccc(CNS(=O)(=O)c2cn3c(n2)CCCC3)cc1
InChIInChI=1S/C17H22N4O3S/c1-20(2)17(22)14-8-6-13(7-9-14)11-18-25(23,24)16-12-21-10-4-3-5-15(21)19-16/h6-9,12,18H,3-5,10-11H2,1-2H3
InChIKeyVVEWPLBFKRVQPV-UHFFFAOYSA-N
MW362.46 g/mol
LogP1.40
Rot. Bonds5

About N,N-dimethyl-4-[(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-ylsulfonylamino)methyl]benzamide

N,N-dimethyl-4-[(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-ylsulfonylamino)methyl]benzamide (PubChem CID 139000833) has the molecular formula C17H22N4O3S and a molecular weight of 362.46 g/mol. Its IUPAC name is N,N-dimethyl-4-[(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-ylsulfonylamino)methyl]benzamide.

Molecular Properties

Compound NameN,N-dimethyl-4-[(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-ylsulfonylamino)methyl]benzamide
PubChem CID139000833
Molecular FormulaC17H22N4O3S
Molecular Weight362.46 g/mol
Exact Mass362.14
IUPAC NameN,N-dimethyl-4-[(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-ylsulfonylamino)methyl]benzamide
SMILESCN(C)C(=O)c1ccc(CNS(=O)(=O)c2cn3c(n2)CCCC3)cc1
InChIInChI=1S/C17H22N4O3S/c1-20(2)17(22)14-8-6-13(7-9-14)11-18-25(23,24)16-12-21-10-4-3-5-15(21)19-16/h6-9,12,18H,3-5,10-11H2,1-2H3
InChIKeyVVEWPLBFKRVQPV-UHFFFAOYSA-N
XLogP1.40
TPSA84.30 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.46
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N,N-dimethyl-4-[(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-ylsulfonylamino)methyl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-[(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-ylsulfonylamino)methyl]benzamide?
The IUPAC name of N,N-dimethyl-4-[(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-ylsulfonylamino)methyl]benzamide (CID 139000833) is N,N-dimethyl-4-[(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-ylsulfonylamino)methyl]benzamide.
What is the SMILES notation for N,N-dimethyl-4-[(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-ylsulfonylamino)methyl]benzamide?
The canonical SMILES for N,N-dimethyl-4-[(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-ylsulfonylamino)methyl]benzamide is CN(C)C(=O)c1ccc(CNS(=O)(=O)c2cn3c(n2)CCCC3)cc1.
What is the InChIKey of N,N-dimethyl-4-[(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-ylsulfonylamino)methyl]benzamide?
The InChIKey is VVEWPLBFKRVQPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N4O3S/c1-20(2)17(22)14-8-6-13(7-9-14)11-18-25(23,24)16-12-21-10-4-3-5-15(21)19-16/h6-9,12,18H,3-5,10-11H2,1-2H3.
What are the key properties of N,N-dimethyl-4-[(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-ylsulfonylamino)methyl]benzamide?
N,N-dimethyl-4-[(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-ylsulfonylamino)methyl]benzamide has a molecular weight of 362.46 g/mol, XLogP of 1.40, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-[(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-ylsulfonylamino)methyl]benzamide is sourced from PubChem (CID 139000833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).