N-(1-cyclohexylethyl)-4-(ethylaminomethyl)thiophene-2-sulfonamide

C15H26N2O2S2 — CID 106056863

IUPACN-(1-cyclohexylethyl)-4-(ethylaminomethyl)thiophene-2-sulfonamide
SMILESCCNCc1csc(S(=O)(=O)NC(C)C2CCCCC2)c1
InChIInChI=1S/C15H26N2O2S2/c1-3-16-10-13-9-15(20-11-13)21(18,19)17-12(2)14-7-5-4-6-8-14/h9,11-12,14,16-17H,3-8,10H2,1-2H3
InChIKeyMQZBJEFDUQRTHX-UHFFFAOYSA-N
MW330.52 g/mol
LogP3.10
Rot. Bonds7

About N-(1-cyclohexylethyl)-4-(ethylaminomethyl)thiophene-2-sulfonamide

N-(1-cyclohexylethyl)-4-(ethylaminomethyl)thiophene-2-sulfonamide (PubChem CID 106056863) has the molecular formula C15H26N2O2S2 and a molecular weight of 330.52 g/mol. Its IUPAC name is N-(1-cyclohexylethyl)-4-(ethylaminomethyl)thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-(1-cyclohexylethyl)-4-(ethylaminomethyl)thiophene-2-sulfonamide
PubChem CID106056863
Molecular FormulaC15H26N2O2S2
Molecular Weight330.52 g/mol
Exact Mass330.14
IUPAC NameN-(1-cyclohexylethyl)-4-(ethylaminomethyl)thiophene-2-sulfonamide
SMILESCCNCc1csc(S(=O)(=O)NC(C)C2CCCCC2)c1
InChIInChI=1S/C15H26N2O2S2/c1-3-16-10-13-9-15(20-11-13)21(18,19)17-12(2)14-7-5-4-6-8-14/h9,11-12,14,16-17H,3-8,10H2,1-2H3
InChIKeyMQZBJEFDUQRTHX-UHFFFAOYSA-N
XLogP3.10
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.52
LogP ≤ 53.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1-cyclopentylethyl)-4-(ethylaminomethyl)thiophene-2-sulfonamide
CID 106066079
N-(1-cyclopentylethyl)-4-[(propan-2-ylamino)methyl]thiophene-2-sulfonamide
CID 106065988
N-(1-cyclopropylpropan-2-yl)-4-(ethylaminomethyl)thiophene-2-sulfonamide
CID 106065790
N-(1-cyclobutylethyl)-5-(ethylaminomethyl)pyridine-2-sulfonamide
CID 106084753
4-(ethylaminomethyl)-N',N'-dimethylthiophene-2-sulfonohydrazide
CID 106074851
4-[(cyclopropylamino)methyl]-N-(2-methylpentan-3-yl)thiophene-2-sulfonamide
CID 106018930
4-(ethylaminomethyl)-N-(2,2,3,3-tetramethylcyclopropyl)thiophene-2-sulfonamide
CID 79356541
N-(1-cyclopropylpropan-2-yl)-4-(methylaminomethyl)thiophene-2-sulfonamide
CID 106065876
N-(1-cyclohexylethyl)-4-methyl-5-(methylaminomethyl)thiophene-2-sulfonamide
CID 106056840
4-[(cyclopropylamino)methyl]-N-(1-cyclopropylbutan-2-yl)thiophene-2-sulfonamide
CID 106063979
4-(ethylaminomethyl)-N-[1-(4-methyl-1,2,4-triazol-3-yl)ethyl]thiophene-2-sulfonamide
CID 106004702
4-(ethylaminomethyl)-N-(3-methylsulfanylbutyl)thiophene-2-sulfonamide
CID 106082258

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclohexylethyl)-4-(ethylaminomethyl)thiophene-2-sulfonamide?
The IUPAC name of N-(1-cyclohexylethyl)-4-(ethylaminomethyl)thiophene-2-sulfonamide (CID 106056863) is N-(1-cyclohexylethyl)-4-(ethylaminomethyl)thiophene-2-sulfonamide.
What is the SMILES notation for N-(1-cyclohexylethyl)-4-(ethylaminomethyl)thiophene-2-sulfonamide?
The canonical SMILES for N-(1-cyclohexylethyl)-4-(ethylaminomethyl)thiophene-2-sulfonamide is CCNCc1csc(S(=O)(=O)NC(C)C2CCCCC2)c1.
What is the InChIKey of N-(1-cyclohexylethyl)-4-(ethylaminomethyl)thiophene-2-sulfonamide?
The InChIKey is MQZBJEFDUQRTHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2S2/c1-3-16-10-13-9-15(20-11-13)21(18,19)17-12(2)14-7-5-4-6-8-14/h9,11-12,14,16-17H,3-8,10H2,1-2H3.
What are the key properties of N-(1-cyclohexylethyl)-4-(ethylaminomethyl)thiophene-2-sulfonamide?
N-(1-cyclohexylethyl)-4-(ethylaminomethyl)thiophene-2-sulfonamide has a molecular weight of 330.52 g/mol, XLogP of 3.10, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclohexylethyl)-4-(ethylaminomethyl)thiophene-2-sulfonamide is sourced from PubChem (CID 106056863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).