N-(cyclopentylmethyl)-5-[2-(methylamino)ethyl]thiophene-2-sulfonamide

C13H22N2O2S2 — CID 106027253

IUPACN-(cyclopentylmethyl)-5-[2-(methylamino)ethyl]thiophene-2-sulfonamide
SMILESCNCCc1ccc(S(=O)(=O)NCC2CCCC2)s1
InChIInChI=1S/C13H22N2O2S2/c1-14-9-8-12-6-7-13(18-12)19(16,17)15-10-11-4-2-3-5-11/h6-7,11,14-15H,2-5,8-10H2,1H3
InChIKeyQKPOIUMBQXBMTE-UHFFFAOYSA-N
MW302.47 g/mol
LogP1.98
Rot. Bonds7

About N-(cyclopentylmethyl)-5-[2-(methylamino)ethyl]thiophene-2-sulfonamide

N-(cyclopentylmethyl)-5-[2-(methylamino)ethyl]thiophene-2-sulfonamide (PubChem CID 106027253) has the molecular formula C13H22N2O2S2 and a molecular weight of 302.47 g/mol. Its IUPAC name is N-(cyclopentylmethyl)-5-[2-(methylamino)ethyl]thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-(cyclopentylmethyl)-5-[2-(methylamino)ethyl]thiophene-2-sulfonamide
PubChem CID106027253
Molecular FormulaC13H22N2O2S2
Molecular Weight302.47 g/mol
Exact Mass302.11
IUPAC NameN-(cyclopentylmethyl)-5-[2-(methylamino)ethyl]thiophene-2-sulfonamide
SMILESCNCCc1ccc(S(=O)(=O)NCC2CCCC2)s1
InChIInChI=1S/C13H22N2O2S2/c1-14-9-8-12-6-7-13(18-12)19(16,17)15-10-11-4-2-3-5-11/h6-7,11,14-15H,2-5,8-10H2,1H3
InChIKeyQKPOIUMBQXBMTE-UHFFFAOYSA-N
XLogP1.98
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.47
LogP ≤ 51.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(cyclopentylmethyl)-5-[2-(methylamino)ethyl]thiophene-2-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(cyclopentylmethyl)-5-[2-(propan-2-ylamino)ethyl]thiophene-2-sulfonamide
CID 106027132
5-[2-(methylamino)ethyl]-N-[(2-methylcyclohexyl)methyl]thiophene-2-sulfonamide
CID 106018540
5-[2-(methylamino)ethyl]-N-(2-methylsulfanylcyclohexyl)thiophene-2-sulfonamide
CID 106091476
5-ethyl-N-[(4-hydroxycyclohexyl)methyl]thiophene-2-sulfonamide
CID 106126554
5-chloro-N-(cyclohexylmethyl)thiophene-2-sulfonamide
CID 6470902
N-[(3-bromocyclohexyl)methyl]-5-ethylthiophene-2-sulfonamide
CID 106135842
5-[2-(ethylamino)ethyl]-N-[(3-methylcyclopentyl)methyl]thiophene-2-sulfonamide
CID 106089895
5-[2-(methylamino)ethyl]-N-[(1-methylsulfanylcyclopentyl)methyl]thiophene-2-sulfonamide
CID 106090568
5-(methylaminomethyl)-N-(thiolan-3-ylmethyl)thiophene-2-sulfonamide
CID 106089015
5-[2-(methylamino)ethyl]-N-(1-methylpiperidin-4-yl)thiophene-2-sulfonamide
CID 106025620
N-(2-ethoxypropyl)-5-[2-(methylamino)ethyl]thiophene-2-sulfonamide
CID 106078895
5-cyano-N-(cyclopentylmethyl)thiophene-2-sulfonamide
CID 106267298

Frequently Asked Questions

What is the IUPAC name of N-(cyclopentylmethyl)-5-[2-(methylamino)ethyl]thiophene-2-sulfonamide?
The IUPAC name of N-(cyclopentylmethyl)-5-[2-(methylamino)ethyl]thiophene-2-sulfonamide (CID 106027253) is N-(cyclopentylmethyl)-5-[2-(methylamino)ethyl]thiophene-2-sulfonamide.
What is the SMILES notation for N-(cyclopentylmethyl)-5-[2-(methylamino)ethyl]thiophene-2-sulfonamide?
The canonical SMILES for N-(cyclopentylmethyl)-5-[2-(methylamino)ethyl]thiophene-2-sulfonamide is CNCCc1ccc(S(=O)(=O)NCC2CCCC2)s1.
What is the InChIKey of N-(cyclopentylmethyl)-5-[2-(methylamino)ethyl]thiophene-2-sulfonamide?
The InChIKey is QKPOIUMBQXBMTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O2S2/c1-14-9-8-12-6-7-13(18-12)19(16,17)15-10-11-4-2-3-5-11/h6-7,11,14-15H,2-5,8-10H2,1H3.
What are the key properties of N-(cyclopentylmethyl)-5-[2-(methylamino)ethyl]thiophene-2-sulfonamide?
N-(cyclopentylmethyl)-5-[2-(methylamino)ethyl]thiophene-2-sulfonamide has a molecular weight of 302.47 g/mol, XLogP of 1.98, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopentylmethyl)-5-[2-(methylamino)ethyl]thiophene-2-sulfonamide is sourced from PubChem (CID 106027253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).