N-[(4-hydroxycyclohexyl)methyl]thiophene-2-sulfonamide

C11H17NO3S2 — CID 114147059

IUPACN-[(4-hydroxycyclohexyl)methyl]thiophene-2-sulfonamide
SMILESO=S(=O)(NCC1CCC(O)CC1)c1cccs1
InChIInChI=1S/C11H17NO3S2/c13-10-5-3-9(4-6-10)8-12-17(14,15)11-2-1-7-16-11/h1-2,7,9-10,12-13H,3-6,8H2
InChIKeyGUZDLLAEAKXUSJ-UHFFFAOYSA-N
MW275.39 g/mol
LogP1.58
Rot. Bonds4

About N-[(4-hydroxycyclohexyl)methyl]thiophene-2-sulfonamide

N-[(4-hydroxycyclohexyl)methyl]thiophene-2-sulfonamide (PubChem CID 114147059) has the molecular formula C11H17NO3S2 and a molecular weight of 275.39 g/mol. Its IUPAC name is N-[(4-hydroxycyclohexyl)methyl]thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-[(4-hydroxycyclohexyl)methyl]thiophene-2-sulfonamide
PubChem CID114147059
Molecular FormulaC11H17NO3S2
Molecular Weight275.39 g/mol
Exact Mass275.06
IUPAC NameN-[(4-hydroxycyclohexyl)methyl]thiophene-2-sulfonamide
SMILESO=S(=O)(NCC1CCC(O)CC1)c1cccs1
InChIInChI=1S/C11H17NO3S2/c13-10-5-3-9(4-6-10)8-12-17(14,15)11-2-1-7-16-11/h1-2,7,9-10,12-13H,3-6,8H2
InChIKeyGUZDLLAEAKXUSJ-UHFFFAOYSA-N
XLogP1.58
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.39
LogP ≤ 51.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(3-hydroxycyclobutyl)methyl]thiophene-2-sulfonamide
CID 66006317
N,N-dimethyl-4-[(thiophen-2-ylsulfonylamino)methyl]piperidine-1-sulfonamide
CID 131702793
N-(4-acetylphenyl)-4-[(thiophen-2-ylsulfonylamino)methyl]cyclohexane-1-carboxamide
CID 15989581
N-[(1-methylpiperidin-3-yl)methyl]thiophene-2-sulfonamide
CID 142818973
N-[(4-methoxyphenyl)methyl]-4-[(thiophen-2-ylsulfonylamino)methyl]cyclohexane-1-carboxamide
CID 5322910
5-ethyl-N-[(4-hydroxycyclohexyl)methyl]thiophene-2-sulfonamide
CID 106126554
2,6-difluoro-N-[(4-hydroxycyclohexyl)methyl]benzenesulfonamide
CID 106126597
N-[[1-(pyridine-3-carbonyl)piperidin-4-yl]methyl]thiophene-2-sulfonamide
CID 90521136
N-(13-tricyclo[8.2.1.03,8]trideca-3,5,7-trienylmethyl)thiophene-2-sulfonamide
CID 91354078
N-[[2-(bromomethyl)cyclohexyl]methyl]thiophene-2-sulfonamide
CID 114295389
N-[(1-methyl-5-oxopyrrolidin-3-yl)methyl]thiophene-2-sulfonamide
CID 110737130
N-(2-methoxy-5-methylphenyl)-4-[(thiophen-2-ylsulfonylamino)methyl]cyclohexane-1-carboxamide
CID 22430563

Frequently Asked Questions

What is the IUPAC name of N-[(4-hydroxycyclohexyl)methyl]thiophene-2-sulfonamide?
The IUPAC name of N-[(4-hydroxycyclohexyl)methyl]thiophene-2-sulfonamide (CID 114147059) is N-[(4-hydroxycyclohexyl)methyl]thiophene-2-sulfonamide.
What is the SMILES notation for N-[(4-hydroxycyclohexyl)methyl]thiophene-2-sulfonamide?
The canonical SMILES for N-[(4-hydroxycyclohexyl)methyl]thiophene-2-sulfonamide is O=S(=O)(NCC1CCC(O)CC1)c1cccs1.
What is the InChIKey of N-[(4-hydroxycyclohexyl)methyl]thiophene-2-sulfonamide?
The InChIKey is GUZDLLAEAKXUSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO3S2/c13-10-5-3-9(4-6-10)8-12-17(14,15)11-2-1-7-16-11/h1-2,7,9-10,12-13H,3-6,8H2.
What are the key properties of N-[(4-hydroxycyclohexyl)methyl]thiophene-2-sulfonamide?
N-[(4-hydroxycyclohexyl)methyl]thiophene-2-sulfonamide has a molecular weight of 275.39 g/mol, XLogP of 1.58, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-hydroxycyclohexyl)methyl]thiophene-2-sulfonamide is sourced from PubChem (CID 114147059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).