N-[2-[furan-2-ylmethyl(methylsulfonyl)amino]ethyl]cyclohexanecarboxamide

C15H24N2O4S — CID 113066450

IUPACN-[2-[furan-2-ylmethyl(methylsulfonyl)amino]ethyl]cyclohexanecarboxamide
SMILESCS(=O)(=O)N(CCNC(=O)C1CCCCC1)Cc1ccco1
InChIInChI=1S/C15H24N2O4S/c1-22(19,20)17(12-14-8-5-11-21-14)10-9-16-15(18)13-6-3-2-4-7-13/h5,8,11,13H,2-4,6-7,9-10,12H2,1H3,(H,16,18)
InChIKeyVIQCCYZHMPITIN-UHFFFAOYSA-N
MW328.43 g/mol
LogP1.74
Rot. Bonds7

About N-[2-[furan-2-ylmethyl(methylsulfonyl)amino]ethyl]cyclohexanecarboxamide

N-[2-[furan-2-ylmethyl(methylsulfonyl)amino]ethyl]cyclohexanecarboxamide (PubChem CID 113066450) has the molecular formula C15H24N2O4S and a molecular weight of 328.43 g/mol. Its IUPAC name is N-[2-[furan-2-ylmethyl(methylsulfonyl)amino]ethyl]cyclohexanecarboxamide.

Molecular Properties

Compound NameN-[2-[furan-2-ylmethyl(methylsulfonyl)amino]ethyl]cyclohexanecarboxamide
PubChem CID113066450
Molecular FormulaC15H24N2O4S
Molecular Weight328.43 g/mol
Exact Mass328.15
IUPAC NameN-[2-[furan-2-ylmethyl(methylsulfonyl)amino]ethyl]cyclohexanecarboxamide
SMILESCS(=O)(=O)N(CCNC(=O)C1CCCCC1)Cc1ccco1
InChIInChI=1S/C15H24N2O4S/c1-22(19,20)17(12-14-8-5-11-21-14)10-9-16-15(18)13-6-3-2-4-7-13/h5,8,11,13H,2-4,6-7,9-10,12H2,1H3,(H,16,18)
InChIKeyVIQCCYZHMPITIN-UHFFFAOYSA-N
XLogP1.74
TPSA79.62 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.43
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[2-[furan-2-ylmethyl(methylsulfonyl)amino]ethyl]cyclohexanecarboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[2-[methylsulfonyl(pyridin-4-ylmethyl)amino]ethyl]cyclohexanecarboxamide
CID 113067409
2-ethyl-N-[2-[furan-2-ylmethyl(methylsulfonyl)amino]ethyl]butanamide
CID 113066453
N-[2-(furan-2-yl)ethyl]cyclopentanecarboxamide
CID 110733508
N-[2-[(4-fluorophenyl)methyl-methylsulfonylamino]ethyl]cyclobutanecarboxamide
CID 113066986
N-cyclopentyl-2-[furan-2-ylmethyl(methylsulfonyl)amino]acetamide
CID 113150243
N-(furan-2-ylmethyl)-N-(3-oxo-3-pyrrolidin-1-ylpropyl)methanesulfonamide
CID 113138450
N-[2-[furan-2-ylmethyl(methylsulfonyl)amino]ethyl]-2-(3-methylphenyl)acetamide
CID 113066497
N-[2-(2-chloro-N-methylsulfonylanilino)ethyl]cyclohexanecarboxamide
CID 113069805
2-(4-chlorophenoxy)-N-[2-[furan-2-ylmethyl(methylsulfonyl)amino]ethyl]acetamide
CID 113066480
N-[2-[methylsulfonyl(pyridin-4-ylmethyl)amino]ethyl]cyclopropanecarboxamide
CID 113067406
3-[furan-2-ylmethyl(methylsulfonyl)amino]-N-(3-methylbutyl)propanamide
CID 113138509
3-[furan-2-ylmethyl(methylsulfonyl)amino]-N-(2-phenylethyl)propanamide
CID 113138485

Frequently Asked Questions

What is the IUPAC name of N-[2-[furan-2-ylmethyl(methylsulfonyl)amino]ethyl]cyclohexanecarboxamide?
The IUPAC name of N-[2-[furan-2-ylmethyl(methylsulfonyl)amino]ethyl]cyclohexanecarboxamide (CID 113066450) is N-[2-[furan-2-ylmethyl(methylsulfonyl)amino]ethyl]cyclohexanecarboxamide.
What is the SMILES notation for N-[2-[furan-2-ylmethyl(methylsulfonyl)amino]ethyl]cyclohexanecarboxamide?
The canonical SMILES for N-[2-[furan-2-ylmethyl(methylsulfonyl)amino]ethyl]cyclohexanecarboxamide is CS(=O)(=O)N(CCNC(=O)C1CCCCC1)Cc1ccco1.
What is the InChIKey of N-[2-[furan-2-ylmethyl(methylsulfonyl)amino]ethyl]cyclohexanecarboxamide?
The InChIKey is VIQCCYZHMPITIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O4S/c1-22(19,20)17(12-14-8-5-11-21-14)10-9-16-15(18)13-6-3-2-4-7-13/h5,8,11,13H,2-4,6-7,9-10,12H2,1H3,(H,16,18).
What are the key properties of N-[2-[furan-2-ylmethyl(methylsulfonyl)amino]ethyl]cyclohexanecarboxamide?
N-[2-[furan-2-ylmethyl(methylsulfonyl)amino]ethyl]cyclohexanecarboxamide has a molecular weight of 328.43 g/mol, XLogP of 1.74, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[furan-2-ylmethyl(methylsulfonyl)amino]ethyl]cyclohexanecarboxamide is sourced from PubChem (CID 113066450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).