N-[2-(1H-indol-2-yl)ethyl]methanesulfonamide

C11H14N2O2S — CID 20598528

IUPACN-[2-(1H-indol-2-yl)ethyl]methanesulfonamide
SMILESCS(=O)(=O)NCCc1cc2ccccc2[nH]1
InChIInChI=1S/C11H14N2O2S/c1-16(14,15)12-7-6-10-8-9-4-2-3-5-11(9)13-10/h2-5,8,12-13H,6-7H2,1H3
InChIKeyHMJPSWJQEMGALS-UHFFFAOYSA-N
MW238.31 g/mol
LogP1.26
Rot. Bonds4

About N-[2-(1H-indol-2-yl)ethyl]methanesulfonamide

N-[2-(1H-indol-2-yl)ethyl]methanesulfonamide (PubChem CID 20598528) has the molecular formula C11H14N2O2S and a molecular weight of 238.31 g/mol. Its IUPAC name is N-[2-(1H-indol-2-yl)ethyl]methanesulfonamide.

Molecular Properties

Compound NameN-[2-(1H-indol-2-yl)ethyl]methanesulfonamide
PubChem CID20598528
Molecular FormulaC11H14N2O2S
Molecular Weight238.31 g/mol
Exact Mass238.08
IUPAC NameN-[2-(1H-indol-2-yl)ethyl]methanesulfonamide
SMILESCS(=O)(=O)NCCc1cc2ccccc2[nH]1
InChIInChI=1S/C11H14N2O2S/c1-16(14,15)12-7-6-10-8-9-4-2-3-5-11(9)13-10/h2-5,8,12-13H,6-7H2,1H3
InChIKeyHMJPSWJQEMGALS-UHFFFAOYSA-N
XLogP1.26
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.31
LogP ≤ 51.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(1H-indol-2-yl)ethyl]acetamide
CID 10465460
2-(1H-indol-2-yl)-N-methoxyethanamine
CID 154141059
2-(2-fluoroethyl)-1H-indole
CID 142633825
1-[2-(1H-indol-2-yl)ethyl]-3-propan-2-ylurea
CID 75385727
2-chloro-3-[2-(1H-indol-2-yl)ethylamino]naphthalene-1,4-dione
CID 142721289
3-[2-(1H-indol-2-yl)ethylamino]-2-methyl-3-oxopropanoic acid
CID 122065768
4-(1H-indol-2-yl)butan-2-one
CID 10954278
1-(1H-indol-2-yl)-N,N-dimethylmethanesulfonamide
CID 173052004
N-[2-(1H-indol-2-yl)ethyl]-1-methyl-7-(methylamino)-2,4-dioxoquinazoline-6-sulfonamide
CID 166007273
2-heptyl-1H-indole
CID 3719004
1H-indol-2-ylmethanesulfonamide
CID 54351083
2-hexyl-1H-indole
CID 14299246

Frequently Asked Questions

What is the IUPAC name of N-[2-(1H-indol-2-yl)ethyl]methanesulfonamide?
The IUPAC name of N-[2-(1H-indol-2-yl)ethyl]methanesulfonamide (CID 20598528) is N-[2-(1H-indol-2-yl)ethyl]methanesulfonamide.
What is the SMILES notation for N-[2-(1H-indol-2-yl)ethyl]methanesulfonamide?
The canonical SMILES for N-[2-(1H-indol-2-yl)ethyl]methanesulfonamide is CS(=O)(=O)NCCc1cc2ccccc2[nH]1.
What is the InChIKey of N-[2-(1H-indol-2-yl)ethyl]methanesulfonamide?
The InChIKey is HMJPSWJQEMGALS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O2S/c1-16(14,15)12-7-6-10-8-9-4-2-3-5-11(9)13-10/h2-5,8,12-13H,6-7H2,1H3.
What are the key properties of N-[2-(1H-indol-2-yl)ethyl]methanesulfonamide?
N-[2-(1H-indol-2-yl)ethyl]methanesulfonamide has a molecular weight of 238.31 g/mol, XLogP of 1.26, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1H-indol-2-yl)ethyl]methanesulfonamide is sourced from PubChem (CID 20598528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).