N-[(1-piperidin-1-ylcyclohexyl)methyl]thiophene-2-sulfonamide

C16H26N2O2S2 — CID 9109210

IUPACN-[(1-piperidin-1-ylcyclohexyl)methyl]thiophene-2-sulfonamide
SMILESO=S(=O)(NCC1(N2CCCCC2)CCCCC1)c1cccs1
InChIInChI=1S/C16H26N2O2S2/c19-22(20,15-8-7-13-21-15)17-14-16(9-3-1-4-10-16)18-11-5-2-6-12-18/h7-8,13,17H,1-6,9-12,14H2
InChIKeyHYKLZLXVUQYDOM-UHFFFAOYSA-N
MW342.53 g/mol
LogP3.22
Rot. Bonds5

About N-[(1-piperidin-1-ylcyclohexyl)methyl]thiophene-2-sulfonamide

N-[(1-piperidin-1-ylcyclohexyl)methyl]thiophene-2-sulfonamide (PubChem CID 9109210) has the molecular formula C16H26N2O2S2 and a molecular weight of 342.53 g/mol. Its IUPAC name is N-[(1-piperidin-1-ylcyclohexyl)methyl]thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-[(1-piperidin-1-ylcyclohexyl)methyl]thiophene-2-sulfonamide
PubChem CID9109210
Molecular FormulaC16H26N2O2S2
Molecular Weight342.53 g/mol
Exact Mass342.14
IUPAC NameN-[(1-piperidin-1-ylcyclohexyl)methyl]thiophene-2-sulfonamide
SMILESO=S(=O)(NCC1(N2CCCCC2)CCCCC1)c1cccs1
InChIInChI=1S/C16H26N2O2S2/c19-22(20,15-8-7-13-21-15)17-14-16(9-3-1-4-10-16)18-11-5-2-6-12-18/h7-8,13,17H,1-6,9-12,14H2
InChIKeyHYKLZLXVUQYDOM-UHFFFAOYSA-N
XLogP3.22
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.53
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(1-piperidin-1-ylcyclohexyl)methyl]thiophene-2-sulfonamide?
The IUPAC name of N-[(1-piperidin-1-ylcyclohexyl)methyl]thiophene-2-sulfonamide (CID 9109210) is N-[(1-piperidin-1-ylcyclohexyl)methyl]thiophene-2-sulfonamide.
What is the SMILES notation for N-[(1-piperidin-1-ylcyclohexyl)methyl]thiophene-2-sulfonamide?
The canonical SMILES for N-[(1-piperidin-1-ylcyclohexyl)methyl]thiophene-2-sulfonamide is O=S(=O)(NCC1(N2CCCCC2)CCCCC1)c1cccs1.
What is the InChIKey of N-[(1-piperidin-1-ylcyclohexyl)methyl]thiophene-2-sulfonamide?
The InChIKey is HYKLZLXVUQYDOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O2S2/c19-22(20,15-8-7-13-21-15)17-14-16(9-3-1-4-10-16)18-11-5-2-6-12-18/h7-8,13,17H,1-6,9-12,14H2.
What are the key properties of N-[(1-piperidin-1-ylcyclohexyl)methyl]thiophene-2-sulfonamide?
N-[(1-piperidin-1-ylcyclohexyl)methyl]thiophene-2-sulfonamide has a molecular weight of 342.53 g/mol, XLogP of 3.22, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-piperidin-1-ylcyclohexyl)methyl]thiophene-2-sulfonamide is sourced from PubChem (CID 9109210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).