[4-(2,3-dihydro-1H-indol-6-ylsulfonyl)morpholin-2-yl]methanol

C13H18N2O4S — CID 81205308

IUPAC[4-(2,3-dihydro-1H-indol-6-ylsulfonyl)morpholin-2-yl]methanol
SMILESO=S(=O)(c1ccc2c(c1)NCC2)N1CCOC(CO)C1
InChIInChI=1S/C13H18N2O4S/c16-9-11-8-15(5-6-19-11)20(17,18)12-2-1-10-3-4-14-13(10)7-12/h1-2,7,11,14,16H,3-6,8-9H2
InChIKeyOXGMQWGCOFXPAE-UHFFFAOYSA-N
MW298.36 g/mol
LogP0.04
Rot. Bonds3

About [4-(2,3-dihydro-1H-indol-6-ylsulfonyl)morpholin-2-yl]methanol

[4-(2,3-dihydro-1H-indol-6-ylsulfonyl)morpholin-2-yl]methanol (PubChem CID 81205308) has the molecular formula C13H18N2O4S and a molecular weight of 298.36 g/mol. Its IUPAC name is [4-(2,3-dihydro-1H-indol-6-ylsulfonyl)morpholin-2-yl]methanol.

Molecular Properties

Compound Name[4-(2,3-dihydro-1H-indol-6-ylsulfonyl)morpholin-2-yl]methanol
PubChem CID81205308
Molecular FormulaC13H18N2O4S
Molecular Weight298.36 g/mol
Exact Mass298.10
IUPAC Name[4-(2,3-dihydro-1H-indol-6-ylsulfonyl)morpholin-2-yl]methanol
SMILESO=S(=O)(c1ccc2c(c1)NCC2)N1CCOC(CO)C1
InChIInChI=1S/C13H18N2O4S/c16-9-11-8-15(5-6-19-11)20(17,18)12-2-1-10-3-4-14-13(10)7-12/h1-2,7,11,14,16H,3-6,8-9H2
InChIKeyOXGMQWGCOFXPAE-UHFFFAOYSA-N
XLogP0.04
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.36
LogP ≤ 50.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[1-(2,3-dihydro-1H-indol-6-ylsulfonyl)piperidin-3-yl]ethanol
CID 107227904
[4-(4-amino-3-methylphenyl)sulfonylmorpholin-2-yl]methanol
CID 81205844
[4-(4-methyl-3-nitrophenyl)sulfonylmorpholin-2-yl]methanol
CID 81208390
2-[1-(1,2,3,4-tetrahydroquinolin-7-ylsulfonyl)pyrrolidin-3-yl]ethanol
CID 114798323
2-methyl-4-(1,2,3,4-tetrahydroquinolin-6-ylsulfonyl)morpholine
CID 43119875
[4-(1H-pyrazol-5-ylsulfonyl)morpholin-2-yl]methanol
CID 102693223
4-(2,3-dihydro-1H-indol-6-ylsulfonyl)piperazine-2,6-dione
CID 66062795
4-[2-(hydroxymethyl)morpholin-4-yl]sulfonyl-N-methylbenzamide
CID 81209377
[4-[(5-bromo-3-pyridinyl)sulfonyl]morpholin-2-yl]methanol
CID 81218928
7-(3,4-dimethylpyrrolidin-1-yl)sulfonyl-1,2,3,4-tetrahydroquinoline
CID 79181143
[4-(2,4-dibromophenyl)sulfonylmorpholin-2-yl]methanol
CID 81219809
3-[2-(hydroxymethyl)morpholin-4-yl]sulfonyl-1H-pyridin-4-one
CID 81208935

Frequently Asked Questions

What is the IUPAC name of [4-(2,3-dihydro-1H-indol-6-ylsulfonyl)morpholin-2-yl]methanol?
The IUPAC name of [4-(2,3-dihydro-1H-indol-6-ylsulfonyl)morpholin-2-yl]methanol (CID 81205308) is [4-(2,3-dihydro-1H-indol-6-ylsulfonyl)morpholin-2-yl]methanol.
What is the SMILES notation for [4-(2,3-dihydro-1H-indol-6-ylsulfonyl)morpholin-2-yl]methanol?
The canonical SMILES for [4-(2,3-dihydro-1H-indol-6-ylsulfonyl)morpholin-2-yl]methanol is O=S(=O)(c1ccc2c(c1)NCC2)N1CCOC(CO)C1.
What is the InChIKey of [4-(2,3-dihydro-1H-indol-6-ylsulfonyl)morpholin-2-yl]methanol?
The InChIKey is OXGMQWGCOFXPAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O4S/c16-9-11-8-15(5-6-19-11)20(17,18)12-2-1-10-3-4-14-13(10)7-12/h1-2,7,11,14,16H,3-6,8-9H2.
What are the key properties of [4-(2,3-dihydro-1H-indol-6-ylsulfonyl)morpholin-2-yl]methanol?
[4-(2,3-dihydro-1H-indol-6-ylsulfonyl)morpholin-2-yl]methanol has a molecular weight of 298.36 g/mol, XLogP of 0.04, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2,3-dihydro-1H-indol-6-ylsulfonyl)morpholin-2-yl]methanol is sourced from PubChem (CID 81205308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).