4-methyl-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperazine-1-sulfonamide

C14H21N5O2S — CID 131889625

IUPAC4-methyl-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperazine-1-sulfonamide
SMILESCc1cccc2nc(CNS(=O)(=O)N3CCN(C)CC3)cn12
InChIInChI=1S/C14H21N5O2S/c1-12-4-3-5-14-16-13(11-19(12)14)10-15-22(20,21)18-8-6-17(2)7-9-18/h3-5,11,15H,6-10H2,1-2H3
InChIKeyXCXLGJUECPIRPO-UHFFFAOYSA-N
MW323.42 g/mol
LogP0.22
Rot. Bonds4

About 4-methyl-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperazine-1-sulfonamide

4-methyl-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperazine-1-sulfonamide (PubChem CID 131889625) has the molecular formula C14H21N5O2S and a molecular weight of 323.42 g/mol. Its IUPAC name is 4-methyl-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperazine-1-sulfonamide.

Molecular Properties

Compound Name4-methyl-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperazine-1-sulfonamide
PubChem CID131889625
Molecular FormulaC14H21N5O2S
Molecular Weight323.42 g/mol
Exact Mass323.14
IUPAC Name4-methyl-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperazine-1-sulfonamide
SMILESCc1cccc2nc(CNS(=O)(=O)N3CCN(C)CC3)cn12
InChIInChI=1S/C14H21N5O2S/c1-12-4-3-5-14-16-13(11-19(12)14)10-15-22(20,21)18-8-6-17(2)7-9-18/h3-5,11,15H,6-10H2,1-2H3
InChIKeyXCXLGJUECPIRPO-UHFFFAOYSA-N
XLogP0.22
TPSA69.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.42
LogP ≤ 50.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-methyl-N-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]imidazo[1,2-a]pyridine-2-carboxamide
CID 55395152
3-[methyl-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]amino]propanoic acid
CID 119911563
2-(methylamino)-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]acetamide
CID 83626352
trans-(1R,2R)-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2-(1-methylpyrazol-4-yl)cyclopropane-1-carboxamide
CID 126810964
2-amino-2-methyl-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]propanamide;dihydrochloride
CID 119882818
1-hydroxy-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]cyclopentane-1-carboxamide
CID 111112321
1-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(2-methyl-1,3,4,5-tetrahydro-2-benzazepin-8-yl)urea
CID 166303754
6-chloro-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]pyrazin-2-amine
CID 133296691
2-[methyl-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]amino]acetic acid
CID 119906000
N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-4,5-dihydro-1,3-thiazol-2-amine
CID 4701980
N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-4-[(3-methylphenyl)methyl]piperazine-1-carboxamide
CID 121497168
N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]pyrrolidine-3-carboxamide
CID 119882870

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperazine-1-sulfonamide?
The IUPAC name of 4-methyl-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperazine-1-sulfonamide (CID 131889625) is 4-methyl-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperazine-1-sulfonamide.
What is the SMILES notation for 4-methyl-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperazine-1-sulfonamide?
The canonical SMILES for 4-methyl-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperazine-1-sulfonamide is Cc1cccc2nc(CNS(=O)(=O)N3CCN(C)CC3)cn12.
What is the InChIKey of 4-methyl-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperazine-1-sulfonamide?
The InChIKey is XCXLGJUECPIRPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5O2S/c1-12-4-3-5-14-16-13(11-19(12)14)10-15-22(20,21)18-8-6-17(2)7-9-18/h3-5,11,15H,6-10H2,1-2H3.
What are the key properties of 4-methyl-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperazine-1-sulfonamide?
4-methyl-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperazine-1-sulfonamide has a molecular weight of 323.42 g/mol, XLogP of 0.22, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperazine-1-sulfonamide is sourced from PubChem (CID 131889625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).