N-cyclopropyl-5-ethyl-N-(piperidin-4-ylmethyl)thiophene-2-sulfonamide

C15H24N2O2S2 — CID 79702302

IUPACN-cyclopropyl-5-ethyl-N-(piperidin-4-ylmethyl)thiophene-2-sulfonamide
SMILESCCc1ccc(S(=O)(=O)N(CC2CCNCC2)C2CC2)s1
InChIInChI=1S/C15H24N2O2S2/c1-2-14-5-6-15(20-14)21(18,19)17(13-3-4-13)11-12-7-9-16-10-8-12/h5-6,12-13,16H,2-4,7-11H2,1H3
InChIKeyNOBRHMOXIQKAKG-UHFFFAOYSA-N
MW328.50 g/mol
LogP2.46
Rot. Bonds6

About N-cyclopropyl-5-ethyl-N-(piperidin-4-ylmethyl)thiophene-2-sulfonamide

N-cyclopropyl-5-ethyl-N-(piperidin-4-ylmethyl)thiophene-2-sulfonamide (PubChem CID 79702302) has the molecular formula C15H24N2O2S2 and a molecular weight of 328.50 g/mol. Its IUPAC name is N-cyclopropyl-5-ethyl-N-(piperidin-4-ylmethyl)thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-cyclopropyl-5-ethyl-N-(piperidin-4-ylmethyl)thiophene-2-sulfonamide
PubChem CID79702302
Molecular FormulaC15H24N2O2S2
Molecular Weight328.50 g/mol
Exact Mass328.13
IUPAC NameN-cyclopropyl-5-ethyl-N-(piperidin-4-ylmethyl)thiophene-2-sulfonamide
SMILESCCc1ccc(S(=O)(=O)N(CC2CCNCC2)C2CC2)s1
InChIInChI=1S/C15H24N2O2S2/c1-2-14-5-6-15(20-14)21(18,19)17(13-3-4-13)11-12-7-9-16-10-8-12/h5-6,12-13,16H,2-4,7-11H2,1H3
InChIKeyNOBRHMOXIQKAKG-UHFFFAOYSA-N
XLogP2.46
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.50
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-5-ethyl-N-(piperidin-4-ylmethyl)thiophene-2-sulfonamide?
The IUPAC name of N-cyclopropyl-5-ethyl-N-(piperidin-4-ylmethyl)thiophene-2-sulfonamide (CID 79702302) is N-cyclopropyl-5-ethyl-N-(piperidin-4-ylmethyl)thiophene-2-sulfonamide.
What is the SMILES notation for N-cyclopropyl-5-ethyl-N-(piperidin-4-ylmethyl)thiophene-2-sulfonamide?
The canonical SMILES for N-cyclopropyl-5-ethyl-N-(piperidin-4-ylmethyl)thiophene-2-sulfonamide is CCc1ccc(S(=O)(=O)N(CC2CCNCC2)C2CC2)s1.
What is the InChIKey of N-cyclopropyl-5-ethyl-N-(piperidin-4-ylmethyl)thiophene-2-sulfonamide?
The InChIKey is NOBRHMOXIQKAKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2S2/c1-2-14-5-6-15(20-14)21(18,19)17(13-3-4-13)11-12-7-9-16-10-8-12/h5-6,12-13,16H,2-4,7-11H2,1H3.
What are the key properties of N-cyclopropyl-5-ethyl-N-(piperidin-4-ylmethyl)thiophene-2-sulfonamide?
N-cyclopropyl-5-ethyl-N-(piperidin-4-ylmethyl)thiophene-2-sulfonamide has a molecular weight of 328.50 g/mol, XLogP of 2.46, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-5-ethyl-N-(piperidin-4-ylmethyl)thiophene-2-sulfonamide is sourced from PubChem (CID 79702302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).