N-cyclohexyl-N-methyl-4-(5-methyl-1,3,4-oxadiazol-2-yl)furan-2-sulfonamide

C14H19N3O4S — CID 53175727

IUPACN-cyclohexyl-N-methyl-4-(5-methyl-1,3,4-oxadiazol-2-yl)furan-2-sulfonamide
SMILESCc1nnc(-c2coc(S(=O)(=O)N(C)C3CCCCC3)c2)o1
InChIInChI=1S/C14H19N3O4S/c1-10-15-16-14(21-10)11-8-13(20-9-11)22(18,19)17(2)12-6-4-3-5-7-12/h8-9,12H,3-7H2,1-2H3
InChIKeyRXLZWGDHPJDHEG-UHFFFAOYSA-N
MW325.39 g/mol
LogP2.59
Rot. Bonds4

About N-cyclohexyl-N-methyl-4-(5-methyl-1,3,4-oxadiazol-2-yl)furan-2-sulfonamide

N-cyclohexyl-N-methyl-4-(5-methyl-1,3,4-oxadiazol-2-yl)furan-2-sulfonamide (PubChem CID 53175727) has the molecular formula C14H19N3O4S and a molecular weight of 325.39 g/mol. Its IUPAC name is N-cyclohexyl-N-methyl-4-(5-methyl-1,3,4-oxadiazol-2-yl)furan-2-sulfonamide.

Molecular Properties

Compound NameN-cyclohexyl-N-methyl-4-(5-methyl-1,3,4-oxadiazol-2-yl)furan-2-sulfonamide
PubChem CID53175727
Molecular FormulaC14H19N3O4S
Molecular Weight325.39 g/mol
Exact Mass325.11
IUPAC NameN-cyclohexyl-N-methyl-4-(5-methyl-1,3,4-oxadiazol-2-yl)furan-2-sulfonamide
SMILESCc1nnc(-c2coc(S(=O)(=O)N(C)C3CCCCC3)c2)o1
InChIInChI=1S/C14H19N3O4S/c1-10-15-16-14(21-10)11-8-13(20-9-11)22(18,19)17(2)12-6-4-3-5-7-12/h8-9,12H,3-7H2,1-2H3
InChIKeyRXLZWGDHPJDHEG-UHFFFAOYSA-N
XLogP2.59
TPSA89.44 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.39
LogP ≤ 52.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N-methyl-4-(5-methyl-1,3,4-oxadiazol-2-yl)furan-2-sulfonamide?
The IUPAC name of N-cyclohexyl-N-methyl-4-(5-methyl-1,3,4-oxadiazol-2-yl)furan-2-sulfonamide (CID 53175727) is N-cyclohexyl-N-methyl-4-(5-methyl-1,3,4-oxadiazol-2-yl)furan-2-sulfonamide.
What is the SMILES notation for N-cyclohexyl-N-methyl-4-(5-methyl-1,3,4-oxadiazol-2-yl)furan-2-sulfonamide?
The canonical SMILES for N-cyclohexyl-N-methyl-4-(5-methyl-1,3,4-oxadiazol-2-yl)furan-2-sulfonamide is Cc1nnc(-c2coc(S(=O)(=O)N(C)C3CCCCC3)c2)o1.
What is the InChIKey of N-cyclohexyl-N-methyl-4-(5-methyl-1,3,4-oxadiazol-2-yl)furan-2-sulfonamide?
The InChIKey is RXLZWGDHPJDHEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O4S/c1-10-15-16-14(21-10)11-8-13(20-9-11)22(18,19)17(2)12-6-4-3-5-7-12/h8-9,12H,3-7H2,1-2H3.
What are the key properties of N-cyclohexyl-N-methyl-4-(5-methyl-1,3,4-oxadiazol-2-yl)furan-2-sulfonamide?
N-cyclohexyl-N-methyl-4-(5-methyl-1,3,4-oxadiazol-2-yl)furan-2-sulfonamide has a molecular weight of 325.39 g/mol, XLogP of 2.59, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N-methyl-4-(5-methyl-1,3,4-oxadiazol-2-yl)furan-2-sulfonamide is sourced from PubChem (CID 53175727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).