1,3-dimethyl-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]pyrazolo[5,4-b]pyridine-5-sulfonamide

C16H20N6O2S — CID 129341409

IUPAC1,3-dimethyl-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]pyrazolo[5,4-b]pyridine-5-sulfonamide
SMILESCc1nn(C)c2ncc(S(=O)(=O)NC[C@H]3CCn4ccnc4C3)cc12
InChIInChI=1S/C16H20N6O2S/c1-11-14-8-13(10-18-16(14)21(2)20-11)25(23,24)19-9-12-3-5-22-6-4-17-15(22)7-12/h4,6,8,10,12,19H,3,5,7,9H2,1-2H3/t12-/m0/s1
InChIKeyYUXIELNROVQTRZ-LBPRGKRZSA-N
MW360.44 g/mol
LogP1.01
Rot. Bonds4

About 1,3-dimethyl-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]pyrazolo[5,4-b]pyridine-5-sulfonamide

1,3-dimethyl-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]pyrazolo[5,4-b]pyridine-5-sulfonamide (PubChem CID 129341409) has the molecular formula C16H20N6O2S and a molecular weight of 360.44 g/mol. Its IUPAC name is 1,3-dimethyl-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]pyrazolo[5,4-b]pyridine-5-sulfonamide.

Molecular Properties

Compound Name1,3-dimethyl-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]pyrazolo[5,4-b]pyridine-5-sulfonamide
PubChem CID129341409
Molecular FormulaC16H20N6O2S
Molecular Weight360.44 g/mol
Exact Mass360.14
IUPAC Name1,3-dimethyl-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]pyrazolo[5,4-b]pyridine-5-sulfonamide
SMILESCc1nn(C)c2ncc(S(=O)(=O)NC[C@H]3CCn4ccnc4C3)cc12
InChIInChI=1S/C16H20N6O2S/c1-11-14-8-13(10-18-16(14)21(2)20-11)25(23,24)19-9-12-3-5-22-6-4-17-15(22)7-12/h4,6,8,10,12,19H,3,5,7,9H2,1-2H3/t12-/m0/s1
InChIKeyYUXIELNROVQTRZ-LBPRGKRZSA-N
XLogP1.01
TPSA94.70 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.44
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 1,3-dimethyl-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]pyrazolo[5,4-b]pyridine-5-sulfonamide with MolForge

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Related Compounds

2,5-dimethyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-ylmethyl)thiophene-3-sulfonamide
CID 128967311
5-bromo-2-methyl-N-[[(7R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]thiophene-3-sulfonamide
CID 129339275
N-(2-aminoethyl)-1,3-dimethylpyrazolo[5,4-b]pyridine-5-sulfonamide
CID 119960338
5-methyl-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]thiophene-2-sulfonamide
CID 129334999
N-(2-aminoethyl)-1,3-dimethylpyrazolo[5,4-b]pyridine-5-sulfonamide;hydrochloride
CID 119960337
5-bromo-4-methyl-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]thiophene-2-sulfonamide
CID 129332677
4-chloro-3-cyano-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-ylmethyl)benzenesulfonamide
CID 129003002
5-cyano-2-methyl-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]benzenesulfonamide
CID 129337322
(2S)-2-methyl-N-[[(7R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]-2,3-dihydro-1-benzofuran-5-sulfonamide
CID 129342004
1,3-dimethyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-ylmethyl)pyrazolo[5,4-b]pyridine-5-sulfonamide
CID 75493835
N-(8-azabicyclo[3.2.1]octan-3-yl)-1,3-dimethylpyrazolo[5,4-b]pyridine-5-sulfonamide
CID 119968198
N-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methyl]-1-[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanamine
CID 129475985

Frequently Asked Questions

What is the IUPAC name of 1,3-dimethyl-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]pyrazolo[5,4-b]pyridine-5-sulfonamide?
The IUPAC name of 1,3-dimethyl-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]pyrazolo[5,4-b]pyridine-5-sulfonamide (CID 129341409) is 1,3-dimethyl-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]pyrazolo[5,4-b]pyridine-5-sulfonamide.
What is the SMILES notation for 1,3-dimethyl-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]pyrazolo[5,4-b]pyridine-5-sulfonamide?
The canonical SMILES for 1,3-dimethyl-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]pyrazolo[5,4-b]pyridine-5-sulfonamide is Cc1nn(C)c2ncc(S(=O)(=O)NC[C@H]3CCn4ccnc4C3)cc12.
What is the InChIKey of 1,3-dimethyl-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]pyrazolo[5,4-b]pyridine-5-sulfonamide?
The InChIKey is YUXIELNROVQTRZ-LBPRGKRZSA-N. The full InChI is InChI=1S/C16H20N6O2S/c1-11-14-8-13(10-18-16(14)21(2)20-11)25(23,24)19-9-12-3-5-22-6-4-17-15(22)7-12/h4,6,8,10,12,19H,3,5,7,9H2,1-2H3/t12-/m0/s1.
What are the key properties of 1,3-dimethyl-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]pyrazolo[5,4-b]pyridine-5-sulfonamide?
1,3-dimethyl-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]pyrazolo[5,4-b]pyridine-5-sulfonamide has a molecular weight of 360.44 g/mol, XLogP of 1.01, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethyl-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]pyrazolo[5,4-b]pyridine-5-sulfonamide is sourced from PubChem (CID 129341409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).