5-(2-chlorophenyl)sulfonyl-3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine

C13H14ClN3O2S — CID 110872730

IUPAC5-(2-chlorophenyl)sulfonyl-3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine
SMILESCn1cnc2c1CN(S(=O)(=O)c1ccccc1Cl)CC2
InChIInChI=1S/C13H14ClN3O2S/c1-16-9-15-11-6-7-17(8-12(11)16)20(18,19)13-5-3-2-4-10(13)14/h2-5,9H,6-8H2,1H3
InChIKeyQCGGTDVMHGKHDB-UHFFFAOYSA-N
MW311.79 g/mol
LogP1.82
Rot. Bonds2

About 5-(2-chlorophenyl)sulfonyl-3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine

5-(2-chlorophenyl)sulfonyl-3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine (PubChem CID 110872730) has the molecular formula C13H14ClN3O2S and a molecular weight of 311.79 g/mol. Its IUPAC name is 5-(2-chlorophenyl)sulfonyl-3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine.

Molecular Properties

Compound Name5-(2-chlorophenyl)sulfonyl-3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine
PubChem CID110872730
Molecular FormulaC13H14ClN3O2S
Molecular Weight311.79 g/mol
Exact Mass311.05
IUPAC Name5-(2-chlorophenyl)sulfonyl-3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine
SMILESCn1cnc2c1CN(S(=O)(=O)c1ccccc1Cl)CC2
InChIInChI=1S/C13H14ClN3O2S/c1-16-9-15-11-6-7-17(8-12(11)16)20(18,19)13-5-3-2-4-10(13)14/h2-5,9H,6-8H2,1H3
InChIKeyQCGGTDVMHGKHDB-UHFFFAOYSA-N
XLogP1.82
TPSA55.20 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.79
LogP ≤ 51.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

5-(2-chlorophenyl)sulfonyl-3-propan-2-yl-6,7-dihydro-4H-imidazo[4,5-c]pyridine
CID 110872833
5-(benzenesulfonyl)-3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine
CID 110872676
5-(4-methoxy-2-methylphenyl)sulfonyl-3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine
CID 110872691
3-methyl-5-(2,4,6-trimethylphenyl)sulfonyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine
CID 110872686
5-(2-methylphenyl)sulfonyl-3-propan-2-yl-6,7-dihydro-4H-imidazo[4,5-c]pyridine
CID 110872831
[5-(2-chlorophenyl)sulfonyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-6-yl]methanol
CID 131695843
5-(1,3-benzodioxol-5-ylsulfonyl)-3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine
CID 110872696
5-(2-chlorophenyl)sulfonyl-6,7-dihydro-4H-[1,2]oxazolo[4,5-c]pyridine
CID 86265135
11-(2-chlorophenyl)sulfonyl-2,6,7,11-tetrazatricyclo[7.4.0.03,7]trideca-1(9),2,4-trien-8-one
CID 87052553
1-(2-chlorophenyl)sulfonyl-4-(3-methyl-2-pyridinyl)piperazine
CID 68555914
1-(2-chlorophenyl)sulfonyl-4-pentylpiperazine
CID 45369123
4-(2-chlorophenyl)sulfonylmorpholine
CID 7938037

Frequently Asked Questions

What is the IUPAC name of 5-(2-chlorophenyl)sulfonyl-3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine?
The IUPAC name of 5-(2-chlorophenyl)sulfonyl-3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine (CID 110872730) is 5-(2-chlorophenyl)sulfonyl-3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine.
What is the SMILES notation for 5-(2-chlorophenyl)sulfonyl-3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine?
The canonical SMILES for 5-(2-chlorophenyl)sulfonyl-3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine is Cn1cnc2c1CN(S(=O)(=O)c1ccccc1Cl)CC2.
What is the InChIKey of 5-(2-chlorophenyl)sulfonyl-3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine?
The InChIKey is QCGGTDVMHGKHDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14ClN3O2S/c1-16-9-15-11-6-7-17(8-12(11)16)20(18,19)13-5-3-2-4-10(13)14/h2-5,9H,6-8H2,1H3.
What are the key properties of 5-(2-chlorophenyl)sulfonyl-3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine?
5-(2-chlorophenyl)sulfonyl-3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine has a molecular weight of 311.79 g/mol, XLogP of 1.82, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-chlorophenyl)sulfonyl-3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine is sourced from PubChem (CID 110872730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).