2-(1,2,3,4-tetrahydronaphthalen-2-ylamino)ethanesulfonamide

C12H18N2O2S — CID 43777346

IUPAC2-(1,2,3,4-tetrahydronaphthalen-2-ylamino)ethanesulfonamide
SMILESNS(=O)(=O)CCNC1CCc2ccccc2C1
InChIInChI=1S/C12H18N2O2S/c13-17(15,16)8-7-14-12-6-5-10-3-1-2-4-11(10)9-12/h1-4,12,14H,5-9H2,(H2,13,15,16)
InChIKeyUJTPGKASCJPSRV-UHFFFAOYSA-N
MW254.35 g/mol
LogP0.42
Rot. Bonds4

About 2-(1,2,3,4-tetrahydronaphthalen-2-ylamino)ethanesulfonamide

2-(1,2,3,4-tetrahydronaphthalen-2-ylamino)ethanesulfonamide (PubChem CID 43777346) has the molecular formula C12H18N2O2S and a molecular weight of 254.35 g/mol. Its IUPAC name is 2-(1,2,3,4-tetrahydronaphthalen-2-ylamino)ethanesulfonamide.

Molecular Properties

Compound Name2-(1,2,3,4-tetrahydronaphthalen-2-ylamino)ethanesulfonamide
PubChem CID43777346
Molecular FormulaC12H18N2O2S
Molecular Weight254.35 g/mol
Exact Mass254.11
IUPAC Name2-(1,2,3,4-tetrahydronaphthalen-2-ylamino)ethanesulfonamide
SMILESNS(=O)(=O)CCNC1CCc2ccccc2C1
InChIInChI=1S/C12H18N2O2S/c13-17(15,16)8-7-14-12-6-5-10-3-1-2-4-11(10)9-12/h1-4,12,14H,5-9H2,(H2,13,15,16)
InChIKeyUJTPGKASCJPSRV-UHFFFAOYSA-N
XLogP0.42
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.35
LogP ≤ 50.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]amino]propan-1-ol
CID 93026634
2-(cyclopropylamino)-N-(2,3-dihydro-1H-inden-2-yl)ethanesulfonamide
CID 106087839
N-decyl-1,2,3,4-tetrahydronaphthalen-2-amine
CID 60669476
N-ethyl-N-[3-(1,2,3,4-tetrahydronaphthalen-2-ylamino)propyl]methanesulfonamide
CID 61014017
N-(4-sulfamoylbutyl)-1,2,3,4-tetrahydronaphthalene-2-sulfonamide
CID 167822169
N-[2-(4-bromophenoxy)ethyl]-1,2,3,4-tetrahydronaphthalen-2-amine
CID 63492101
N-(cyclobutylmethyl)-1,2,3,4-tetrahydronaphthalen-2-amine
CID 43775224
2-(2,3-dihydro-1H-inden-2-ylamino)-N-ethylethanesulfonamide
CID 103901891
N-[(4-aminophenyl)methyl]-1,2,3,4-tetrahydronaphthalen-2-amine
CID 89120982
N-(3-butoxypropyl)-1,2,3,4-tetrahydronaphthalen-2-amine
CID 115572613
2-(sulfamoylamino)-2,3-dihydro-1H-indene
CID 45117541
2-methyl-3-(1,2,3,4-tetrahydronaphthalen-2-ylamino)propanamide
CID 62305780

Frequently Asked Questions

What is the IUPAC name of 2-(1,2,3,4-tetrahydronaphthalen-2-ylamino)ethanesulfonamide?
The IUPAC name of 2-(1,2,3,4-tetrahydronaphthalen-2-ylamino)ethanesulfonamide (CID 43777346) is 2-(1,2,3,4-tetrahydronaphthalen-2-ylamino)ethanesulfonamide.
What is the SMILES notation for 2-(1,2,3,4-tetrahydronaphthalen-2-ylamino)ethanesulfonamide?
The canonical SMILES for 2-(1,2,3,4-tetrahydronaphthalen-2-ylamino)ethanesulfonamide is NS(=O)(=O)CCNC1CCc2ccccc2C1.
What is the InChIKey of 2-(1,2,3,4-tetrahydronaphthalen-2-ylamino)ethanesulfonamide?
The InChIKey is UJTPGKASCJPSRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2S/c13-17(15,16)8-7-14-12-6-5-10-3-1-2-4-11(10)9-12/h1-4,12,14H,5-9H2,(H2,13,15,16).
What are the key properties of 2-(1,2,3,4-tetrahydronaphthalen-2-ylamino)ethanesulfonamide?
2-(1,2,3,4-tetrahydronaphthalen-2-ylamino)ethanesulfonamide has a molecular weight of 254.35 g/mol, XLogP of 0.42, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,2,3,4-tetrahydronaphthalen-2-ylamino)ethanesulfonamide is sourced from PubChem (CID 43777346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).