2-(5-piperidin-1-ylsulfonyl-2,3-dihydroindol-1-yl)acetamide

C15H21N3O3S — CID 31873783

IUPAC2-(5-piperidin-1-ylsulfonyl-2,3-dihydroindol-1-yl)acetamide
SMILESNC(=O)CN1CCc2cc(S(=O)(=O)N3CCCCC3)ccc21
InChIInChI=1S/C15H21N3O3S/c16-15(19)11-17-9-6-12-10-13(4-5-14(12)17)22(20,21)18-7-2-1-3-8-18/h4-5,10H,1-3,6-9,11H2,(H2,16,19)
InChIKeyUQJOIODKIARNOL-UHFFFAOYSA-N
MW323.42 g/mol
LogP0.71
Rot. Bonds4

About 2-(5-piperidin-1-ylsulfonyl-2,3-dihydroindol-1-yl)acetamide

2-(5-piperidin-1-ylsulfonyl-2,3-dihydroindol-1-yl)acetamide (PubChem CID 31873783) has the molecular formula C15H21N3O3S and a molecular weight of 323.42 g/mol. Its IUPAC name is 2-(5-piperidin-1-ylsulfonyl-2,3-dihydroindol-1-yl)acetamide.

Molecular Properties

Compound Name2-(5-piperidin-1-ylsulfonyl-2,3-dihydroindol-1-yl)acetamide
PubChem CID31873783
Molecular FormulaC15H21N3O3S
Molecular Weight323.42 g/mol
Exact Mass323.13
IUPAC Name2-(5-piperidin-1-ylsulfonyl-2,3-dihydroindol-1-yl)acetamide
SMILESNC(=O)CN1CCc2cc(S(=O)(=O)N3CCCCC3)ccc21
InChIInChI=1S/C15H21N3O3S/c16-15(19)11-17-9-6-12-10-13(4-5-14(12)17)22(20,21)18-7-2-1-3-8-18/h4-5,10H,1-3,6-9,11H2,(H2,16,19)
InChIKeyUQJOIODKIARNOL-UHFFFAOYSA-N
XLogP0.71
TPSA83.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.42
LogP ≤ 50.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[(5-piperidin-1-ylsulfonyl-2,3-dihydroindol-1-yl)methyl]phenol
CID 75451922
2-(6-pyrrolidin-1-ylsulfonyl-2,3-dihydroindol-1-yl)acetic acid;hydrochloride
CID 119922985
4-(5-piperidin-1-ylsulfonyl-2,3-dihydroindole-1-carbonyl)benzamide
CID 55438572
2-fluoro-1-(5-piperidin-1-ylsulfonyl-2,3-dihydroindol-1-yl)prop-2-en-1-one
CID 167990347
1-bicyclo[1.1.0]butanyl-(5-piperidin-1-ylsulfonyl-2,3-dihydroindol-1-yl)methanone
CID 167965906
2-(2,3-dihydroindol-1-yl)-N-(3-pyrrolidin-1-ylsulfonylphenyl)acetamide
CID 4783327
2-(2,3-dihydroindol-1-yl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)acetamide
CID 4784422
ethyl 4-ethyl-2-oxo-6-[(5-piperidin-1-ylsulfonyl-2,3-dihydroindol-1-yl)methyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate
CID 42918921
2-(4-fluorophenyl)sulfanyl-1-(5-piperidin-1-ylsulfonyl-2,3-dihydroindol-1-yl)ethanone
CID 18097857
3-cyclopentylsulfonyl-1-(5-piperidin-1-ylsulfonyl-2,3-dihydroindol-1-yl)propan-1-one
CID 55759883
methyl 2-[2-oxo-2-(5-piperidin-1-ylsulfonyl-2,3-dihydroindol-1-yl)ethyl]sulfanylacetate
CID 24527163
6-(azepan-1-ylsulfonyl)-1-ethyl-3,4-dihydroquinolin-2-one
CID 119055603

Frequently Asked Questions

What is the IUPAC name of 2-(5-piperidin-1-ylsulfonyl-2,3-dihydroindol-1-yl)acetamide?
The IUPAC name of 2-(5-piperidin-1-ylsulfonyl-2,3-dihydroindol-1-yl)acetamide (CID 31873783) is 2-(5-piperidin-1-ylsulfonyl-2,3-dihydroindol-1-yl)acetamide.
What is the SMILES notation for 2-(5-piperidin-1-ylsulfonyl-2,3-dihydroindol-1-yl)acetamide?
The canonical SMILES for 2-(5-piperidin-1-ylsulfonyl-2,3-dihydroindol-1-yl)acetamide is NC(=O)CN1CCc2cc(S(=O)(=O)N3CCCCC3)ccc21.
What is the InChIKey of 2-(5-piperidin-1-ylsulfonyl-2,3-dihydroindol-1-yl)acetamide?
The InChIKey is UQJOIODKIARNOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O3S/c16-15(19)11-17-9-6-12-10-13(4-5-14(12)17)22(20,21)18-7-2-1-3-8-18/h4-5,10H,1-3,6-9,11H2,(H2,16,19).
What are the key properties of 2-(5-piperidin-1-ylsulfonyl-2,3-dihydroindol-1-yl)acetamide?
2-(5-piperidin-1-ylsulfonyl-2,3-dihydroindol-1-yl)acetamide has a molecular weight of 323.42 g/mol, XLogP of 0.71, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-piperidin-1-ylsulfonyl-2,3-dihydroindol-1-yl)acetamide is sourced from PubChem (CID 31873783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).