N-methyl-N-(oxolan-3-yl)-2,3-dihydro-1H-indole-5-sulfonamide

C13H18N2O3S — CID 82742932

IUPACN-methyl-N-(oxolan-3-yl)-2,3-dihydro-1H-indole-5-sulfonamide
SMILESCN(C1CCOC1)S(=O)(=O)c1ccc2c(c1)CCN2
InChIInChI=1S/C13H18N2O3S/c1-15(11-5-7-18-9-11)19(16,17)12-2-3-13-10(8-12)4-6-14-13/h2-3,8,11,14H,4-7,9H2,1H3
InChIKeyXBTINTTVAMKBOT-UHFFFAOYSA-N
MW282.36 g/mol
LogP1.06
Rot. Bonds3

About N-methyl-N-(oxolan-3-yl)-2,3-dihydro-1H-indole-5-sulfonamide

N-methyl-N-(oxolan-3-yl)-2,3-dihydro-1H-indole-5-sulfonamide (PubChem CID 82742932) has the molecular formula C13H18N2O3S and a molecular weight of 282.36 g/mol. Its IUPAC name is N-methyl-N-(oxolan-3-yl)-2,3-dihydro-1H-indole-5-sulfonamide.

Molecular Properties

Compound NameN-methyl-N-(oxolan-3-yl)-2,3-dihydro-1H-indole-5-sulfonamide
PubChem CID82742932
Molecular FormulaC13H18N2O3S
Molecular Weight282.36 g/mol
Exact Mass282.10
IUPAC NameN-methyl-N-(oxolan-3-yl)-2,3-dihydro-1H-indole-5-sulfonamide
SMILESCN(C1CCOC1)S(=O)(=O)c1ccc2c(c1)CCN2
InChIInChI=1S/C13H18N2O3S/c1-15(11-5-7-18-9-11)19(16,17)12-2-3-13-10(8-12)4-6-14-13/h2-3,8,11,14H,4-7,9H2,1H3
InChIKeyXBTINTTVAMKBOT-UHFFFAOYSA-N
XLogP1.06
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.36
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopentyl-N-methyl-2,3-dihydro-1H-indole-5-sulfonamide
CID 43267403
N-cycloheptyl-N-methyl-2,3-dihydro-1H-indole-5-sulfonamide
CID 43614367
N-methyl-N-(oxan-3-ylmethyl)-2,3-dihydro-1H-indole-5-sulfonamide
CID 63708062
N-(2-hydroxycyclohexyl)-N-methyl-2,3-dihydro-1H-indole-5-sulfonamide
CID 102632751
N-methyl-N-propan-2-yl-2,3-dihydro-1H-indole-5-sulfonamide
CID 43119880
2-amino-N-methyl-N-(oxolan-3-yl)pyridine-4-sulfonamide
CID 82743975
4-bromo-N,3-dimethyl-N-(oxolan-3-yl)benzenesulfonamide
CID 78947881
4-amino-N-methyl-N-(oxolan-3-yl)benzenesulfonamide
CID 82741535
N-(oxolan-3-ylmethyl)-2,3-dihydro-1H-indole-5-sulfonamide
CID 62823134
N-butyl-N-cyclopropyl-2,3-dihydro-1H-indole-5-sulfonamide
CID 61443459
3-fluoro-N-methyl-4-nitro-N-(oxolan-3-yl)benzenesulfonamide
CID 82854734
N-ethyl-N-(oxolan-2-ylmethyl)-2,3-dihydro-1H-indole-5-sulfonamide
CID 61435584

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(oxolan-3-yl)-2,3-dihydro-1H-indole-5-sulfonamide?
The IUPAC name of N-methyl-N-(oxolan-3-yl)-2,3-dihydro-1H-indole-5-sulfonamide (CID 82742932) is N-methyl-N-(oxolan-3-yl)-2,3-dihydro-1H-indole-5-sulfonamide.
What is the SMILES notation for N-methyl-N-(oxolan-3-yl)-2,3-dihydro-1H-indole-5-sulfonamide?
The canonical SMILES for N-methyl-N-(oxolan-3-yl)-2,3-dihydro-1H-indole-5-sulfonamide is CN(C1CCOC1)S(=O)(=O)c1ccc2c(c1)CCN2.
What is the InChIKey of N-methyl-N-(oxolan-3-yl)-2,3-dihydro-1H-indole-5-sulfonamide?
The InChIKey is XBTINTTVAMKBOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O3S/c1-15(11-5-7-18-9-11)19(16,17)12-2-3-13-10(8-12)4-6-14-13/h2-3,8,11,14H,4-7,9H2,1H3.
What are the key properties of N-methyl-N-(oxolan-3-yl)-2,3-dihydro-1H-indole-5-sulfonamide?
N-methyl-N-(oxolan-3-yl)-2,3-dihydro-1H-indole-5-sulfonamide has a molecular weight of 282.36 g/mol, XLogP of 1.06, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(oxolan-3-yl)-2,3-dihydro-1H-indole-5-sulfonamide is sourced from PubChem (CID 82742932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).