N-cyclohexyl-1-methylimidazole-4-sulfonamide

C10H17N3O2S — CID 53007762

IUPACN-cyclohexyl-1-methylimidazole-4-sulfonamide
SMILESCn1cnc(S(=O)(=O)NC2CCCCC2)c1
InChIInChI=1S/C10H17N3O2S/c1-13-7-10(11-8-13)16(14,15)12-9-5-3-2-4-6-9/h7-9,12H,2-6H2,1H3
InChIKeyCVKDQYWHCBLHFT-UHFFFAOYSA-N
MW243.33 g/mol
LogP1.03
Rot. Bonds3

About N-cyclohexyl-1-methylimidazole-4-sulfonamide

N-cyclohexyl-1-methylimidazole-4-sulfonamide (PubChem CID 53007762) has the molecular formula C10H17N3O2S and a molecular weight of 243.33 g/mol. Its IUPAC name is N-cyclohexyl-1-methylimidazole-4-sulfonamide.

Molecular Properties

Compound NameN-cyclohexyl-1-methylimidazole-4-sulfonamide
PubChem CID53007762
Molecular FormulaC10H17N3O2S
Molecular Weight243.33 g/mol
Exact Mass243.10
IUPAC NameN-cyclohexyl-1-methylimidazole-4-sulfonamide
SMILESCn1cnc(S(=O)(=O)NC2CCCCC2)c1
InChIInChI=1S/C10H17N3O2S/c1-13-7-10(11-8-13)16(14,15)12-9-5-3-2-4-6-9/h7-9,12H,2-6H2,1H3
InChIKeyCVKDQYWHCBLHFT-UHFFFAOYSA-N
XLogP1.03
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.33
LogP ≤ 51.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-1-methylimidazole-4-sulfonamide?
The IUPAC name of N-cyclohexyl-1-methylimidazole-4-sulfonamide (CID 53007762) is N-cyclohexyl-1-methylimidazole-4-sulfonamide.
What is the SMILES notation for N-cyclohexyl-1-methylimidazole-4-sulfonamide?
The canonical SMILES for N-cyclohexyl-1-methylimidazole-4-sulfonamide is Cn1cnc(S(=O)(=O)NC2CCCCC2)c1.
What is the InChIKey of N-cyclohexyl-1-methylimidazole-4-sulfonamide?
The InChIKey is CVKDQYWHCBLHFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O2S/c1-13-7-10(11-8-13)16(14,15)12-9-5-3-2-4-6-9/h7-9,12H,2-6H2,1H3.
What are the key properties of N-cyclohexyl-1-methylimidazole-4-sulfonamide?
N-cyclohexyl-1-methylimidazole-4-sulfonamide has a molecular weight of 243.33 g/mol, XLogP of 1.03, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-1-methylimidazole-4-sulfonamide is sourced from PubChem (CID 53007762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).