N-methyl-N-propan-2-yl-2,3-dihydro-1H-indole-5-sulfonamide

C12H18N2O2S — CID 43119880

IUPACN-methyl-N-propan-2-yl-2,3-dihydro-1H-indole-5-sulfonamide
SMILESCC(C)N(C)S(=O)(=O)c1ccc2c(c1)CCN2
InChIInChI=1S/C12H18N2O2S/c1-9(2)14(3)17(15,16)11-4-5-12-10(8-11)6-7-13-12/h4-5,8-9,13H,6-7H2,1-3H3
InChIKeyHVVGIGHBWJPOSJ-UHFFFAOYSA-N
MW254.35 g/mol
LogP1.68
Rot. Bonds3

About N-methyl-N-propan-2-yl-2,3-dihydro-1H-indole-5-sulfonamide

N-methyl-N-propan-2-yl-2,3-dihydro-1H-indole-5-sulfonamide (PubChem CID 43119880) has the molecular formula C12H18N2O2S and a molecular weight of 254.35 g/mol. Its IUPAC name is N-methyl-N-propan-2-yl-2,3-dihydro-1H-indole-5-sulfonamide.

Molecular Properties

Compound NameN-methyl-N-propan-2-yl-2,3-dihydro-1H-indole-5-sulfonamide
PubChem CID43119880
Molecular FormulaC12H18N2O2S
Molecular Weight254.35 g/mol
Exact Mass254.11
IUPAC NameN-methyl-N-propan-2-yl-2,3-dihydro-1H-indole-5-sulfonamide
SMILESCC(C)N(C)S(=O)(=O)c1ccc2c(c1)CCN2
InChIInChI=1S/C12H18N2O2S/c1-9(2)14(3)17(15,16)11-4-5-12-10(8-11)6-7-13-12/h4-5,8-9,13H,6-7H2,1-3H3
InChIKeyHVVGIGHBWJPOSJ-UHFFFAOYSA-N
XLogP1.68
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.35
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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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-(1-methoxypropan-2-yl)-N-methyl-1,2,3,4-tetrahydroquinoline-6-sulfonamide
CID 61452430
N-(furan-2-ylmethyl)-N-methyl-2,3-dihydro-1H-indole-5-sulfonamide
CID 43527164
5-ethylsulfonyl-2,3-dihydro-1H-indole
CID 134176519
N-(2-hydroxycyclohexyl)-N-methyl-2,3-dihydro-1H-indole-5-sulfonamide
CID 102632751
N-methyl-N-(1-methylsulfanylpropan-2-yl)-2,3-dihydro-1H-indole-6-sulfonamide
CID 112661678
N-(5-hydroxypentyl)-N-methyl-2,3-dihydro-1H-indole-5-sulfonamide
CID 107200821
N-methyl-N-(oxolan-3-yl)-2,3-dihydro-1H-indole-5-sulfonamide
CID 82742932
N,N-dimethyl-2,3-dihydro-1H-indole-6-sulfonamide
CID 10376417
N-butan-2-yl-N-ethyl-1,2,3,4-tetrahydroquinoline-6-sulfonamide
CID 43274848
N-butyl-N-cyclopropyl-2,3-dihydro-1H-indole-5-sulfonamide
CID 61443459

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-propan-2-yl-2,3-dihydro-1H-indole-5-sulfonamide?
The IUPAC name of N-methyl-N-propan-2-yl-2,3-dihydro-1H-indole-5-sulfonamide (CID 43119880) is N-methyl-N-propan-2-yl-2,3-dihydro-1H-indole-5-sulfonamide.
What is the SMILES notation for N-methyl-N-propan-2-yl-2,3-dihydro-1H-indole-5-sulfonamide?
The canonical SMILES for N-methyl-N-propan-2-yl-2,3-dihydro-1H-indole-5-sulfonamide is CC(C)N(C)S(=O)(=O)c1ccc2c(c1)CCN2.
What is the InChIKey of N-methyl-N-propan-2-yl-2,3-dihydro-1H-indole-5-sulfonamide?
The InChIKey is HVVGIGHBWJPOSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2S/c1-9(2)14(3)17(15,16)11-4-5-12-10(8-11)6-7-13-12/h4-5,8-9,13H,6-7H2,1-3H3.
What are the key properties of N-methyl-N-propan-2-yl-2,3-dihydro-1H-indole-5-sulfonamide?
N-methyl-N-propan-2-yl-2,3-dihydro-1H-indole-5-sulfonamide has a molecular weight of 254.35 g/mol, XLogP of 1.68, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-propan-2-yl-2,3-dihydro-1H-indole-5-sulfonamide is sourced from PubChem (CID 43119880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).