5-thiophen-2-ylsulfonyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine

C10H11N3O2S2 — CID 53145331

IUPAC5-thiophen-2-ylsulfonyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine
SMILESO=S(=O)(c1cccs1)N1CCc2nc[nH]c2C1
InChIInChI=1S/C10H11N3O2S2/c14-17(15,10-2-1-5-16-10)13-4-3-8-9(6-13)12-7-11-8/h1-2,5,7H,3-4,6H2,(H,11,12)
InChIKeyUYBYLMRUHQKMRC-UHFFFAOYSA-N
MW269.35 g/mol
LogP1.22
Rot. Bonds2

About 5-thiophen-2-ylsulfonyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine

5-thiophen-2-ylsulfonyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine (PubChem CID 53145331) has the molecular formula C10H11N3O2S2 and a molecular weight of 269.35 g/mol. Its IUPAC name is 5-thiophen-2-ylsulfonyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine.

Molecular Properties

Compound Name5-thiophen-2-ylsulfonyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine
PubChem CID53145331
Molecular FormulaC10H11N3O2S2
Molecular Weight269.35 g/mol
Exact Mass269.03
IUPAC Name5-thiophen-2-ylsulfonyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine
SMILESO=S(=O)(c1cccs1)N1CCc2nc[nH]c2C1
InChIInChI=1S/C10H11N3O2S2/c14-17(15,10-2-1-5-16-10)13-4-3-8-9(6-13)12-7-11-8/h1-2,5,7H,3-4,6H2,(H,11,12)
InChIKeyUYBYLMRUHQKMRC-UHFFFAOYSA-N
XLogP1.22
TPSA66.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-methyl-7-thiophen-2-ylsulfonyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-one
CID 128999986
4-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-ylsulfonyl)-2,1,3-benzothiadiazole
CID 72864894
5-(3-chloro-4-methylphenyl)sulfonyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 53145359
4-thiophen-2-ylsulfonyl-1,4-diazepan-2-one
CID 62897265
1-thiophen-2-ylsulfonylpiperazine
CID 3865892
1-thiophen-2-ylsulfonylpiperidine
CID 765823
4-thiophen-2-ylsulfonylthiomorpholine
CID 128941068
1-thiophen-2-ylsulfonylpiperazin-4-ium
CID 7016013
2-thiophen-2-ylsulfonyl-3,4-dihydro-1H-isoquinoline-7-carboxylic acid
CID 68580086
1-methyl-4-thiophen-2-ylsulfonyl-3,5-dihydro-2H-pyrido[2,3-e][1,4]diazepine
CID 97468890
8-thiophen-2-ylsulfonyl-2,3,4,7,9,10-hexahydro-[1,4]dioxepino[2,3-g]isoquinoline
CID 4897978
3,4-difluoro-N-(6-thiophen-2-ylsulfonyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-2-yl)benzamide
CID 11575727

Frequently Asked Questions

What is the IUPAC name of 5-thiophen-2-ylsulfonyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine?
The IUPAC name of 5-thiophen-2-ylsulfonyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine (CID 53145331) is 5-thiophen-2-ylsulfonyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine.
What is the SMILES notation for 5-thiophen-2-ylsulfonyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine?
The canonical SMILES for 5-thiophen-2-ylsulfonyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine is O=S(=O)(c1cccs1)N1CCc2nc[nH]c2C1.
What is the InChIKey of 5-thiophen-2-ylsulfonyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine?
The InChIKey is UYBYLMRUHQKMRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O2S2/c14-17(15,10-2-1-5-16-10)13-4-3-8-9(6-13)12-7-11-8/h1-2,5,7H,3-4,6H2,(H,11,12).
What are the key properties of 5-thiophen-2-ylsulfonyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine?
5-thiophen-2-ylsulfonyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine has a molecular weight of 269.35 g/mol, XLogP of 1.22, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-thiophen-2-ylsulfonyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine is sourced from PubChem (CID 53145331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).