N-[[2-(furan-2-yl)-4-methyl-1,3-thiazol-5-yl]methyl]cyclohexanesulfonamide

C15H20N2O3S2 — CID 121123943

IUPACN-[[2-(furan-2-yl)-4-methyl-1,3-thiazol-5-yl]methyl]cyclohexanesulfonamide
SMILESCc1nc(-c2ccco2)sc1CNS(=O)(=O)C1CCCCC1
InChIInChI=1S/C15H20N2O3S2/c1-11-14(21-15(17-11)13-8-5-9-20-13)10-16-22(18,19)12-6-3-2-4-7-12/h5,8-9,12,16H,2-4,6-7,10H2,1H3
InChIKeyMVOOSSHXKFRGPW-UHFFFAOYSA-N
MW340.47 g/mol
LogP3.46
Rot. Bonds5

About N-[[2-(furan-2-yl)-4-methyl-1,3-thiazol-5-yl]methyl]cyclohexanesulfonamide

N-[[2-(furan-2-yl)-4-methyl-1,3-thiazol-5-yl]methyl]cyclohexanesulfonamide (PubChem CID 121123943) has the molecular formula C15H20N2O3S2 and a molecular weight of 340.47 g/mol. Its IUPAC name is N-[[2-(furan-2-yl)-4-methyl-1,3-thiazol-5-yl]methyl]cyclohexanesulfonamide.

Molecular Properties

Compound NameN-[[2-(furan-2-yl)-4-methyl-1,3-thiazol-5-yl]methyl]cyclohexanesulfonamide
PubChem CID121123943
Molecular FormulaC15H20N2O3S2
Molecular Weight340.47 g/mol
Exact Mass340.09
IUPAC NameN-[[2-(furan-2-yl)-4-methyl-1,3-thiazol-5-yl]methyl]cyclohexanesulfonamide
SMILESCc1nc(-c2ccco2)sc1CNS(=O)(=O)C1CCCCC1
InChIInChI=1S/C15H20N2O3S2/c1-11-14(21-15(17-11)13-8-5-9-20-13)10-16-22(18,19)12-6-3-2-4-7-12/h5,8-9,12,16H,2-4,6-7,10H2,1H3
InChIKeyMVOOSSHXKFRGPW-UHFFFAOYSA-N
XLogP3.46
TPSA72.20 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.47
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[[2-(furan-2-yl)-4-methyl-1,3-thiazol-5-yl]methyl]cyclohexanesulfonamide?
The IUPAC name of N-[[2-(furan-2-yl)-4-methyl-1,3-thiazol-5-yl]methyl]cyclohexanesulfonamide (CID 121123943) is N-[[2-(furan-2-yl)-4-methyl-1,3-thiazol-5-yl]methyl]cyclohexanesulfonamide.
What is the SMILES notation for N-[[2-(furan-2-yl)-4-methyl-1,3-thiazol-5-yl]methyl]cyclohexanesulfonamide?
The canonical SMILES for N-[[2-(furan-2-yl)-4-methyl-1,3-thiazol-5-yl]methyl]cyclohexanesulfonamide is Cc1nc(-c2ccco2)sc1CNS(=O)(=O)C1CCCCC1.
What is the InChIKey of N-[[2-(furan-2-yl)-4-methyl-1,3-thiazol-5-yl]methyl]cyclohexanesulfonamide?
The InChIKey is MVOOSSHXKFRGPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O3S2/c1-11-14(21-15(17-11)13-8-5-9-20-13)10-16-22(18,19)12-6-3-2-4-7-12/h5,8-9,12,16H,2-4,6-7,10H2,1H3.
What are the key properties of N-[[2-(furan-2-yl)-4-methyl-1,3-thiazol-5-yl]methyl]cyclohexanesulfonamide?
N-[[2-(furan-2-yl)-4-methyl-1,3-thiazol-5-yl]methyl]cyclohexanesulfonamide has a molecular weight of 340.47 g/mol, XLogP of 3.46, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(furan-2-yl)-4-methyl-1,3-thiazol-5-yl]methyl]cyclohexanesulfonamide is sourced from PubChem (CID 121123943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).