N-(2-cyclopentyloxyethyl)-2,3-dihydro-1H-indole-5-sulfonamide

C15H22N2O3S — CID 63829043

IUPACN-(2-cyclopentyloxyethyl)-2,3-dihydro-1H-indole-5-sulfonamide
SMILESO=S(=O)(NCCOC1CCCC1)c1ccc2c(c1)CCN2
InChIInChI=1S/C15H22N2O3S/c18-21(19,17-9-10-20-13-3-1-2-4-13)14-5-6-15-12(11-14)7-8-16-15/h5-6,11,13,16-17H,1-4,7-10H2
InChIKeyDVEWBAINVDXAOJ-UHFFFAOYSA-N
MW310.42 g/mol
LogP1.89
Rot. Bonds6

About N-(2-cyclopentyloxyethyl)-2,3-dihydro-1H-indole-5-sulfonamide

N-(2-cyclopentyloxyethyl)-2,3-dihydro-1H-indole-5-sulfonamide (PubChem CID 63829043) has the molecular formula C15H22N2O3S and a molecular weight of 310.42 g/mol. Its IUPAC name is N-(2-cyclopentyloxyethyl)-2,3-dihydro-1H-indole-5-sulfonamide.

Molecular Properties

Compound NameN-(2-cyclopentyloxyethyl)-2,3-dihydro-1H-indole-5-sulfonamide
PubChem CID63829043
Molecular FormulaC15H22N2O3S
Molecular Weight310.42 g/mol
Exact Mass310.14
IUPAC NameN-(2-cyclopentyloxyethyl)-2,3-dihydro-1H-indole-5-sulfonamide
SMILESO=S(=O)(NCCOC1CCCC1)c1ccc2c(c1)CCN2
InChIInChI=1S/C15H22N2O3S/c18-21(19,17-9-10-20-13-3-1-2-4-13)14-5-6-15-12(11-14)7-8-16-15/h5-6,11,13,16-17H,1-4,7-10H2
InChIKeyDVEWBAINVDXAOJ-UHFFFAOYSA-N
XLogP1.89
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.42
LogP ≤ 51.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-amino-N-(2-cyclopentyloxyethyl)-4-methylbenzenesulfonamide
CID 63824236
N-(2-cyclopentyloxyethyl)benzenesulfonamide
CID 61060137
N-(4,4,4-trifluorobutyl)-2,3-dihydro-1H-indole-5-sulfonamide
CID 115520729
4-bromo-N-(2-cyclohexyloxyethyl)benzenesulfonamide
CID 61061043
N-[(3-methylcyclopentyl)methyl]-2,3-dihydro-1H-indole-5-sulfonamide
CID 107414189
3-(aminomethyl)-N-(2-cyclopentyloxyethyl)-4-fluorobenzenesulfonamide
CID 63827191
N-(2-methylcyclohexyl)-2,3-dihydro-1H-indole-5-sulfonamide
CID 43119924
N-(oxolan-3-ylmethyl)-2,3-dihydro-1H-indole-5-sulfonamide
CID 62823134
N-[2-(1H-1,2,4-triazol-5-yl)ethyl]-2,3-dihydro-1H-indole-5-sulfonamide
CID 64531595
N-(3-methylbut-2-enyl)-2,3-dihydro-1H-indole-5-sulfonamide
CID 106191065
4-fluoro-N-(2-piperidin-4-yloxyethyl)benzenesulfonamide
CID 63870153
N-(2-methylbutyl)-2,3-dihydro-1H-indole-5-sulfonamide
CID 62693554

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopentyloxyethyl)-2,3-dihydro-1H-indole-5-sulfonamide?
The IUPAC name of N-(2-cyclopentyloxyethyl)-2,3-dihydro-1H-indole-5-sulfonamide (CID 63829043) is N-(2-cyclopentyloxyethyl)-2,3-dihydro-1H-indole-5-sulfonamide.
What is the SMILES notation for N-(2-cyclopentyloxyethyl)-2,3-dihydro-1H-indole-5-sulfonamide?
The canonical SMILES for N-(2-cyclopentyloxyethyl)-2,3-dihydro-1H-indole-5-sulfonamide is O=S(=O)(NCCOC1CCCC1)c1ccc2c(c1)CCN2.
What is the InChIKey of N-(2-cyclopentyloxyethyl)-2,3-dihydro-1H-indole-5-sulfonamide?
The InChIKey is DVEWBAINVDXAOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O3S/c18-21(19,17-9-10-20-13-3-1-2-4-13)14-5-6-15-12(11-14)7-8-16-15/h5-6,11,13,16-17H,1-4,7-10H2.
What are the key properties of N-(2-cyclopentyloxyethyl)-2,3-dihydro-1H-indole-5-sulfonamide?
N-(2-cyclopentyloxyethyl)-2,3-dihydro-1H-indole-5-sulfonamide has a molecular weight of 310.42 g/mol, XLogP of 1.89, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopentyloxyethyl)-2,3-dihydro-1H-indole-5-sulfonamide is sourced from PubChem (CID 63829043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).