N-(1-cyclopentylethyl)-5-[(cyclopropylamino)methyl]furan-2-sulfonamide

C15H24N2O3S — CID 106066048

IUPACN-(1-cyclopentylethyl)-5-[(cyclopropylamino)methyl]furan-2-sulfonamide
SMILESCC(NS(=O)(=O)c1ccc(CNC2CC2)o1)C1CCCC1
InChIInChI=1S/C15H24N2O3S/c1-11(12-4-2-3-5-12)17-21(18,19)15-9-8-14(20-15)10-16-13-6-7-13/h8-9,11-13,16-17H,2-7,10H2,1H3
InChIKeyAEEOQKQSUGQBTO-UHFFFAOYSA-N
MW312.44 g/mol
LogP2.39
Rot. Bonds7

About N-(1-cyclopentylethyl)-5-[(cyclopropylamino)methyl]furan-2-sulfonamide

N-(1-cyclopentylethyl)-5-[(cyclopropylamino)methyl]furan-2-sulfonamide (PubChem CID 106066048) has the molecular formula C15H24N2O3S and a molecular weight of 312.44 g/mol. Its IUPAC name is N-(1-cyclopentylethyl)-5-[(cyclopropylamino)methyl]furan-2-sulfonamide.

Molecular Properties

Compound NameN-(1-cyclopentylethyl)-5-[(cyclopropylamino)methyl]furan-2-sulfonamide
PubChem CID106066048
Molecular FormulaC15H24N2O3S
Molecular Weight312.44 g/mol
Exact Mass312.15
IUPAC NameN-(1-cyclopentylethyl)-5-[(cyclopropylamino)methyl]furan-2-sulfonamide
SMILESCC(NS(=O)(=O)c1ccc(CNC2CC2)o1)C1CCCC1
InChIInChI=1S/C15H24N2O3S/c1-11(12-4-2-3-5-12)17-21(18,19)15-9-8-14(20-15)10-16-13-6-7-13/h8-9,11-13,16-17H,2-7,10H2,1H3
InChIKeyAEEOQKQSUGQBTO-UHFFFAOYSA-N
XLogP2.39
TPSA71.34 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.44
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(2-Benzenesulfonylamino-acetyl)-cyclopentyl-amino]-N-furan-2-ylmethyl-3-methyl-butyramide
CID 653272
4-[2-(Furan-2-ylmethylamino)ethyl]benzenesulfonamide
CID 4722624
N-(5-Methane-2-furansulfonicacid)(4-sulfonamidephenyl)-ethanamine
CID 44221745
2-(furan-2-ylmethylamino)-N-octylethanesulfonamide
CID 45479984
2-[(2-Benzenesulfonylamino-acetyl)-furan-2-ylmethyl-amino]-N-cyclopentyl-3-methyl-butyramide
CID 3206786
(S)-N-(furan-2-ylmethyl)-4-methyl-2-(4-methylphenylsulfonamido)pentanamide
CID 663471
N-(furan-2-ylmethyl)-4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanamide
CID 2981281
N-Cyclopentyl-N-{[(furan-2-ylmethyl)-carbamoyl]-methyl}-2-(toluene-4-sulfonylamino)-acetamide
CID 3206882
5-[(Benzylamino)methyl]furan-2-sulfonic acid
CID 44221941
5-(methylsulfamoyl)-N-(4-phenylbutan-2-yl)furan-2-carboxamide
CID 45816018
N,N-dimethyl-5-[(2-phenylpyrrolidin-1-yl)methyl]furan-2-sulfonamide
CID 47037707
1-[[5-(Dimethylsulfamoyl)furan-2-yl]methyl]piperidine-4-carboxamide
CID 56796656

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopentylethyl)-5-[(cyclopropylamino)methyl]furan-2-sulfonamide?
The IUPAC name of N-(1-cyclopentylethyl)-5-[(cyclopropylamino)methyl]furan-2-sulfonamide (CID 106066048) is N-(1-cyclopentylethyl)-5-[(cyclopropylamino)methyl]furan-2-sulfonamide.
What is the SMILES notation for N-(1-cyclopentylethyl)-5-[(cyclopropylamino)methyl]furan-2-sulfonamide?
The canonical SMILES for N-(1-cyclopentylethyl)-5-[(cyclopropylamino)methyl]furan-2-sulfonamide is CC(NS(=O)(=O)c1ccc(CNC2CC2)o1)C1CCCC1.
What is the InChIKey of N-(1-cyclopentylethyl)-5-[(cyclopropylamino)methyl]furan-2-sulfonamide?
The InChIKey is AEEOQKQSUGQBTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O3S/c1-11(12-4-2-3-5-12)17-21(18,19)15-9-8-14(20-15)10-16-13-6-7-13/h8-9,11-13,16-17H,2-7,10H2,1H3.
What are the key properties of N-(1-cyclopentylethyl)-5-[(cyclopropylamino)methyl]furan-2-sulfonamide?
N-(1-cyclopentylethyl)-5-[(cyclopropylamino)methyl]furan-2-sulfonamide has a molecular weight of 312.44 g/mol, XLogP of 2.39, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopentylethyl)-5-[(cyclopropylamino)methyl]furan-2-sulfonamide is sourced from PubChem (CID 106066048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).