N-(1-cyclobutylethyl)-5-[2-(cyclopropylamino)ethyl]thiophene-2-sulfonamide

C15H24N2O2S2 — CID 106084827

IUPACN-(1-cyclobutylethyl)-5-[2-(cyclopropylamino)ethyl]thiophene-2-sulfonamide
SMILESCC(NS(=O)(=O)c1ccc(CCNC2CC2)s1)C1CCC1
InChIInChI=1S/C15H24N2O2S2/c1-11(12-3-2-4-12)17-21(18,19)15-8-7-14(20-15)9-10-16-13-5-6-13/h7-8,11-13,16-17H,2-6,9-10H2,1H3
InChIKeyWTWYTSOTWUJADE-UHFFFAOYSA-N
MW328.50 g/mol
LogP2.51
Rot. Bonds8

About N-(1-cyclobutylethyl)-5-[2-(cyclopropylamino)ethyl]thiophene-2-sulfonamide

N-(1-cyclobutylethyl)-5-[2-(cyclopropylamino)ethyl]thiophene-2-sulfonamide (PubChem CID 106084827) has the molecular formula C15H24N2O2S2 and a molecular weight of 328.50 g/mol. Its IUPAC name is N-(1-cyclobutylethyl)-5-[2-(cyclopropylamino)ethyl]thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-(1-cyclobutylethyl)-5-[2-(cyclopropylamino)ethyl]thiophene-2-sulfonamide
PubChem CID106084827
Molecular FormulaC15H24N2O2S2
Molecular Weight328.50 g/mol
Exact Mass328.13
IUPAC NameN-(1-cyclobutylethyl)-5-[2-(cyclopropylamino)ethyl]thiophene-2-sulfonamide
SMILESCC(NS(=O)(=O)c1ccc(CCNC2CC2)s1)C1CCC1
InChIInChI=1S/C15H24N2O2S2/c1-11(12-3-2-4-12)17-21(18,19)15-8-7-14(20-15)9-10-16-13-5-6-13/h7-8,11-13,16-17H,2-6,9-10H2,1H3
InChIKeyWTWYTSOTWUJADE-UHFFFAOYSA-N
XLogP2.51
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.50
LogP ≤ 52.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-[2-(cyclopropylamino)ethyl]-N-(4-methylpentan-2-yl)thiophene-2-sulfonamide
CID 106028590
5-[2-(cyclopropylamino)ethyl]-N-(2-methyloxolan-3-yl)thiophene-2-sulfonamide
CID 106076226
5-[2-(cyclopropylamino)ethyl]-N-(1,3,4-thiadiazol-2-yl)thiophene-2-sulfonamide
CID 106081177
5-ethyl-N-propan-2-ylthiophene-2-sulfonamide
CID 61059652
N-(2-amino-1-cyclohexylethyl)-5-ethylthiophene-2-sulfonamide
CID 115309311
5-bromo-N-(1-cyclopropylethyl)thiophene-2-sulfonamide
CID 55029070
N-[2-(5-bromothiophen-2-yl)ethyl]-4-propan-2-ylcyclohexan-1-amine
CID 106043985
N-(cyclopentylmethyl)-5-[2-(propan-2-ylamino)ethyl]thiophene-2-sulfonamide
CID 106027132
N-(2-amino-1-cyclohexylethyl)-5-ethylthiophene-2-sulfonamide;hydrochloride
CID 119983838
N-[2-[5-(3,6-dihydro-2H-pyridin-1-ylsulfonyl)thiophen-2-yl]ethyl]cyclopropanamine
CID 114414087
4-[(cyclopropylamino)methyl]-N-(1-cyclopropylethyl)benzenesulfonamide
CID 60823571
2-cyclohexyl-2-[(5-ethylthiophen-2-yl)sulfonylamino]acetic acid
CID 61454315

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclobutylethyl)-5-[2-(cyclopropylamino)ethyl]thiophene-2-sulfonamide?
The IUPAC name of N-(1-cyclobutylethyl)-5-[2-(cyclopropylamino)ethyl]thiophene-2-sulfonamide (CID 106084827) is N-(1-cyclobutylethyl)-5-[2-(cyclopropylamino)ethyl]thiophene-2-sulfonamide.
What is the SMILES notation for N-(1-cyclobutylethyl)-5-[2-(cyclopropylamino)ethyl]thiophene-2-sulfonamide?
The canonical SMILES for N-(1-cyclobutylethyl)-5-[2-(cyclopropylamino)ethyl]thiophene-2-sulfonamide is CC(NS(=O)(=O)c1ccc(CCNC2CC2)s1)C1CCC1.
What is the InChIKey of N-(1-cyclobutylethyl)-5-[2-(cyclopropylamino)ethyl]thiophene-2-sulfonamide?
The InChIKey is WTWYTSOTWUJADE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2S2/c1-11(12-3-2-4-12)17-21(18,19)15-8-7-14(20-15)9-10-16-13-5-6-13/h7-8,11-13,16-17H,2-6,9-10H2,1H3.
What are the key properties of N-(1-cyclobutylethyl)-5-[2-(cyclopropylamino)ethyl]thiophene-2-sulfonamide?
N-(1-cyclobutylethyl)-5-[2-(cyclopropylamino)ethyl]thiophene-2-sulfonamide has a molecular weight of 328.50 g/mol, XLogP of 2.51, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclobutylethyl)-5-[2-(cyclopropylamino)ethyl]thiophene-2-sulfonamide is sourced from PubChem (CID 106084827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).