7-methyl-2-[3-[(3R)-3-methylpiperidin-1-yl]sulfonylphenyl]imidazo[1,2-a]pyridine

C20H23N3O2S — CID 7903354

IUPAC7-methyl-2-[3-[(3R)-3-methylpiperidin-1-yl]sulfonylphenyl]imidazo[1,2-a]pyridine
SMILESCc1ccn2cc(-c3cccc(S(=O)(=O)N4CCC[C@@H](C)C4)c3)nc2c1
InChIInChI=1S/C20H23N3O2S/c1-15-8-10-22-14-19(21-20(22)11-15)17-6-3-7-18(12-17)26(24,25)23-9-4-5-16(2)13-23/h3,6-8,10-12,14,16H,4-5,9,13H2,1-2H3/t16-/m1/s1
InChIKeyKVHANWMAAFWQDA-MRXNPFEDSA-N
MW369.49 g/mol
LogP3.73
Rot. Bonds3

About 7-methyl-2-[3-[(3R)-3-methylpiperidin-1-yl]sulfonylphenyl]imidazo[1,2-a]pyridine

7-methyl-2-[3-[(3R)-3-methylpiperidin-1-yl]sulfonylphenyl]imidazo[1,2-a]pyridine (PubChem CID 7903354) has the molecular formula C20H23N3O2S and a molecular weight of 369.49 g/mol. Its IUPAC name is 7-methyl-2-[3-[(3R)-3-methylpiperidin-1-yl]sulfonylphenyl]imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name7-methyl-2-[3-[(3R)-3-methylpiperidin-1-yl]sulfonylphenyl]imidazo[1,2-a]pyridine
PubChem CID7903354
Molecular FormulaC20H23N3O2S
Molecular Weight369.49 g/mol
Exact Mass369.15
IUPAC Name7-methyl-2-[3-[(3R)-3-methylpiperidin-1-yl]sulfonylphenyl]imidazo[1,2-a]pyridine
SMILESCc1ccn2cc(-c3cccc(S(=O)(=O)N4CCC[C@@H](C)C4)c3)nc2c1
InChIInChI=1S/C20H23N3O2S/c1-15-8-10-22-14-19(21-20(22)11-15)17-6-3-7-18(12-17)26(24,25)23-9-4-5-16(2)13-23/h3,6-8,10-12,14,16H,4-5,9,13H2,1-2H3/t16-/m1/s1
InChIKeyKVHANWMAAFWQDA-MRXNPFEDSA-N
XLogP3.73
TPSA54.68 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.49
LogP ≤ 53.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

6-chloro-2-[3-(3-methylpiperidin-1-yl)sulfonylphenyl]imidazo[1,2-a]pyridine
CID 3823159
2-[3-(3-methylpiperidin-1-yl)sulfonylphenyl]imidazo[1,2-a]pyrimidine
CID 664590
8-methyl-2-(3-pyrrolidin-1-ylsulfonylphenyl)imidazo[1,2-a]pyridine
CID 935997
3-(3-methylpiperidin-1-yl)sulfonylbenzenesulfonamide
CID 43235652
(3S)-3-methyl-1-(4-methylphenyl)sulfonylpiperidine
CID 668967
(3S)-3-methyl-1-(4-phenylphenyl)sulfonylpiperidine
CID 40714493
4-[[[4-[3-(3-methylpiperidin-1-yl)sulfonylphenyl]-1,3-thiazol-2-yl]hydrazinylidene]methyl]phenol
CID 4701593
2-(3-pyrrolidin-1-ylsulfonylphenyl)imidazo[1,2-a]pyrimidine
CID 938226
N-[3-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]cyclohexanecarboxamide
CID 1480568
N-(3-methylphenyl)-3-(3-methylpiperidin-1-yl)sulfonylbenzamide
CID 109065568
N-[(2-chlorophenyl)methylideneamino]-4-[3-(3-methylpiperidin-1-yl)sulfonylphenyl]-1,3-thiazol-2-amine
CID 4701479
1-cyclopentyl-2-[(3-methylphenyl)methylsulfanyl]-5-[(3S)-3-methylpiperidin-1-yl]sulfonylbenzimidazole
CID 92772895

Frequently Asked Questions

What is the IUPAC name of 7-methyl-2-[3-[(3R)-3-methylpiperidin-1-yl]sulfonylphenyl]imidazo[1,2-a]pyridine?
The IUPAC name of 7-methyl-2-[3-[(3R)-3-methylpiperidin-1-yl]sulfonylphenyl]imidazo[1,2-a]pyridine (CID 7903354) is 7-methyl-2-[3-[(3R)-3-methylpiperidin-1-yl]sulfonylphenyl]imidazo[1,2-a]pyridine.
What is the SMILES notation for 7-methyl-2-[3-[(3R)-3-methylpiperidin-1-yl]sulfonylphenyl]imidazo[1,2-a]pyridine?
The canonical SMILES for 7-methyl-2-[3-[(3R)-3-methylpiperidin-1-yl]sulfonylphenyl]imidazo[1,2-a]pyridine is Cc1ccn2cc(-c3cccc(S(=O)(=O)N4CCC[C@@H](C)C4)c3)nc2c1.
What is the InChIKey of 7-methyl-2-[3-[(3R)-3-methylpiperidin-1-yl]sulfonylphenyl]imidazo[1,2-a]pyridine?
The InChIKey is KVHANWMAAFWQDA-MRXNPFEDSA-N. The full InChI is InChI=1S/C20H23N3O2S/c1-15-8-10-22-14-19(21-20(22)11-15)17-6-3-7-18(12-17)26(24,25)23-9-4-5-16(2)13-23/h3,6-8,10-12,14,16H,4-5,9,13H2,1-2H3/t16-/m1/s1.
What are the key properties of 7-methyl-2-[3-[(3R)-3-methylpiperidin-1-yl]sulfonylphenyl]imidazo[1,2-a]pyridine?
7-methyl-2-[3-[(3R)-3-methylpiperidin-1-yl]sulfonylphenyl]imidazo[1,2-a]pyridine has a molecular weight of 369.49 g/mol, XLogP of 3.73, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-2-[3-[(3R)-3-methylpiperidin-1-yl]sulfonylphenyl]imidazo[1,2-a]pyridine is sourced from PubChem (CID 7903354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).