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

C15H26N2O2S2 — CID 106027132

IUPACN-(cyclopentylmethyl)-5-[2-(propan-2-ylamino)ethyl]thiophene-2-sulfonamide
SMILESCC(C)NCCc1ccc(S(=O)(=O)NCC2CCCC2)s1
InChIInChI=1S/C15H26N2O2S2/c1-12(2)16-10-9-14-7-8-15(20-14)21(18,19)17-11-13-5-3-4-6-13/h7-8,12-13,16-17H,3-6,9-11H2,1-2H3
InChIKeyABZMCAGZIOXMCJ-UHFFFAOYSA-N
MW330.52 g/mol
LogP2.76
Rot. Bonds8

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

N-(cyclopentylmethyl)-5-[2-(propan-2-ylamino)ethyl]thiophene-2-sulfonamide (PubChem CID 106027132) has the molecular formula C15H26N2O2S2 and a molecular weight of 330.52 g/mol. Its IUPAC name is N-(cyclopentylmethyl)-5-[2-(propan-2-ylamino)ethyl]thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-(cyclopentylmethyl)-5-[2-(propan-2-ylamino)ethyl]thiophene-2-sulfonamide
PubChem CID106027132
Molecular FormulaC15H26N2O2S2
Molecular Weight330.52 g/mol
Exact Mass330.14
IUPAC NameN-(cyclopentylmethyl)-5-[2-(propan-2-ylamino)ethyl]thiophene-2-sulfonamide
SMILESCC(C)NCCc1ccc(S(=O)(=O)NCC2CCCC2)s1
InChIInChI=1S/C15H26N2O2S2/c1-12(2)16-10-9-14-7-8-15(20-14)21(18,19)17-11-13-5-3-4-6-13/h7-8,12-13,16-17H,3-6,9-11H2,1-2H3
InChIKeyABZMCAGZIOXMCJ-UHFFFAOYSA-N
XLogP2.76
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.52
LogP ≤ 52.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(cyclopentylmethyl)-5-[2-(methylamino)ethyl]thiophene-2-sulfonamide
CID 106027253
N-(2-ethoxyethyl)-5-[2-(propan-2-ylamino)ethyl]thiophene-2-sulfonamide
CID 106020076
5-[2-(methylamino)ethyl]-N-[(2-methylcyclohexyl)methyl]thiophene-2-sulfonamide
CID 106018540
5-[2-(propan-2-ylamino)ethyl]-N-pyrimidin-2-ylthiophene-2-sulfonamide
CID 106072041
5-chloro-N-(cyclohexylmethyl)thiophene-2-sulfonamide
CID 6470902
5-ethyl-N-[(1-propan-2-ylpiperidin-4-yl)methyl]thiophene-2-sulfonamide
CID 16887547
5-[2-(ethylamino)ethyl]-N-[(3-methylcyclopentyl)methyl]thiophene-2-sulfonamide
CID 106089895
5-[2-(propan-2-ylamino)ethyl]-N-(1H-1,2,4-triazol-5-ylmethyl)thiophene-2-sulfonamide
CID 106013449
5-ethyl-N-[(4-hydroxycyclohexyl)methyl]thiophene-2-sulfonamide
CID 106126554
5-cyano-N-(cyclopentylmethyl)thiophene-2-sulfonamide
CID 106267298
N-[(3-bromocyclohexyl)methyl]-5-ethylthiophene-2-sulfonamide
CID 106135842
N-(1-cyclobutylethyl)-5-[2-(cyclopropylamino)ethyl]thiophene-2-sulfonamide
CID 106084827

Frequently Asked Questions

What is the IUPAC name of N-(cyclopentylmethyl)-5-[2-(propan-2-ylamino)ethyl]thiophene-2-sulfonamide?
The IUPAC name of N-(cyclopentylmethyl)-5-[2-(propan-2-ylamino)ethyl]thiophene-2-sulfonamide (CID 106027132) is N-(cyclopentylmethyl)-5-[2-(propan-2-ylamino)ethyl]thiophene-2-sulfonamide.
What is the SMILES notation for N-(cyclopentylmethyl)-5-[2-(propan-2-ylamino)ethyl]thiophene-2-sulfonamide?
The canonical SMILES for N-(cyclopentylmethyl)-5-[2-(propan-2-ylamino)ethyl]thiophene-2-sulfonamide is CC(C)NCCc1ccc(S(=O)(=O)NCC2CCCC2)s1.
What is the InChIKey of N-(cyclopentylmethyl)-5-[2-(propan-2-ylamino)ethyl]thiophene-2-sulfonamide?
The InChIKey is ABZMCAGZIOXMCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2S2/c1-12(2)16-10-9-14-7-8-15(20-14)21(18,19)17-11-13-5-3-4-6-13/h7-8,12-13,16-17H,3-6,9-11H2,1-2H3.
What are the key properties of N-(cyclopentylmethyl)-5-[2-(propan-2-ylamino)ethyl]thiophene-2-sulfonamide?
N-(cyclopentylmethyl)-5-[2-(propan-2-ylamino)ethyl]thiophene-2-sulfonamide has a molecular weight of 330.52 g/mol, XLogP of 2.76, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopentylmethyl)-5-[2-(propan-2-ylamino)ethyl]thiophene-2-sulfonamide is sourced from PubChem (CID 106027132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).