N-(2-amino-1-cyclohexylethyl)-5-(methylsulfonylmethyl)furan-2-carboxamide

C15H24N2O4S — CID 119589648

IUPACN-(2-amino-1-cyclohexylethyl)-5-(methylsulfonylmethyl)furan-2-carboxamide
SMILESCS(=O)(=O)Cc1ccc(C(=O)NC(CN)C2CCCCC2)o1
InChIInChI=1S/C15H24N2O4S/c1-22(19,20)10-12-7-8-14(21-12)15(18)17-13(9-16)11-5-3-2-4-6-11/h7-8,11,13H,2-6,9-10,16H2,1H3,(H,17,18)
InChIKeySILOXSNTZBXWMY-UHFFFAOYSA-N
MW328.43 g/mol
LogP1.46
Rot. Bonds6

About N-(2-amino-1-cyclohexylethyl)-5-(methylsulfonylmethyl)furan-2-carboxamide

N-(2-amino-1-cyclohexylethyl)-5-(methylsulfonylmethyl)furan-2-carboxamide (PubChem CID 119589648) has the molecular formula C15H24N2O4S and a molecular weight of 328.43 g/mol. Its IUPAC name is N-(2-amino-1-cyclohexylethyl)-5-(methylsulfonylmethyl)furan-2-carboxamide.

Molecular Properties

Compound NameN-(2-amino-1-cyclohexylethyl)-5-(methylsulfonylmethyl)furan-2-carboxamide
PubChem CID119589648
Molecular FormulaC15H24N2O4S
Molecular Weight328.43 g/mol
Exact Mass328.15
IUPAC NameN-(2-amino-1-cyclohexylethyl)-5-(methylsulfonylmethyl)furan-2-carboxamide
SMILESCS(=O)(=O)Cc1ccc(C(=O)NC(CN)C2CCCCC2)o1
InChIInChI=1S/C15H24N2O4S/c1-22(19,20)10-12-7-8-14(21-12)15(18)17-13(9-16)11-5-3-2-4-6-11/h7-8,11,13H,2-6,9-10,16H2,1H3,(H,17,18)
InChIKeySILOXSNTZBXWMY-UHFFFAOYSA-N
XLogP1.46
TPSA102.40 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.43
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-amino-1-cyclopentylethyl)-5-bromofuran-2-carboxamide
CID 106737570
N-(2-amino-1-cyclohexylethyl)-5-[(1-methylimidazol-2-yl)sulfanylmethyl]furan-2-carboxamide
CID 119589563
N-(1-aminohexan-2-yl)-5-(methylsulfonylmethyl)furan-2-carboxamide
CID 119665668
N-(2-amino-1-cyclohexylethyl)-4-(dimethylsulfamoyl)-5-methylfuran-2-carboxamide;hydrochloride
CID 119592207
N-(2-amino-1-cyclohexylethyl)-2,4,5-trimethylfuran-3-carboxamide
CID 81485921
N-(2-amino-1-cyclohexylethyl)-5-ethyl-4-methylfuran-2-carboxamide;hydrochloride
CID 119590238
N-(2-amino-1-cyclohexylethyl)-5-methylfuro[3,2-b]pyridine-2-carboxamide
CID 119592125
N-(2-amino-1-cyclohexylethyl)-3-pentan-3-yl-1,2-oxazole-5-carboxamide
CID 119589284
N-(2-amino-1-cyclohexylethyl)-4-(methylsulfamoyl)benzamide;hydrochloride
CID 119589468
N-(2-amino-1-cyclopentylethyl)-5-ethylthiophene-2-carboxamide
CID 106737412
2-amino-N-(1-cyclohexylpropyl)-1,3-oxazole-5-carboxamide
CID 167984557
N-[(1R)-1-(3,5-dimethylphenyl)ethyl]-5-(methylsulfonylmethyl)furan-2-carboxamide
CID 95615306

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-1-cyclohexylethyl)-5-(methylsulfonylmethyl)furan-2-carboxamide?
The IUPAC name of N-(2-amino-1-cyclohexylethyl)-5-(methylsulfonylmethyl)furan-2-carboxamide (CID 119589648) is N-(2-amino-1-cyclohexylethyl)-5-(methylsulfonylmethyl)furan-2-carboxamide.
What is the SMILES notation for N-(2-amino-1-cyclohexylethyl)-5-(methylsulfonylmethyl)furan-2-carboxamide?
The canonical SMILES for N-(2-amino-1-cyclohexylethyl)-5-(methylsulfonylmethyl)furan-2-carboxamide is CS(=O)(=O)Cc1ccc(C(=O)NC(CN)C2CCCCC2)o1.
What is the InChIKey of N-(2-amino-1-cyclohexylethyl)-5-(methylsulfonylmethyl)furan-2-carboxamide?
The InChIKey is SILOXSNTZBXWMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O4S/c1-22(19,20)10-12-7-8-14(21-12)15(18)17-13(9-16)11-5-3-2-4-6-11/h7-8,11,13H,2-6,9-10,16H2,1H3,(H,17,18).
What are the key properties of N-(2-amino-1-cyclohexylethyl)-5-(methylsulfonylmethyl)furan-2-carboxamide?
N-(2-amino-1-cyclohexylethyl)-5-(methylsulfonylmethyl)furan-2-carboxamide has a molecular weight of 328.43 g/mol, XLogP of 1.46, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-1-cyclohexylethyl)-5-(methylsulfonylmethyl)furan-2-carboxamide is sourced from PubChem (CID 119589648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).