5-[(cyclopropylamino)methyl]-N-[(3-hydroxycyclobutyl)methyl]furan-2-sulfonamide

C13H20N2O4S — CID 66007251

IUPAC5-[(cyclopropylamino)methyl]-N-[(3-hydroxycyclobutyl)methyl]furan-2-sulfonamide
SMILESO=S(=O)(NCC1CC(O)C1)c1ccc(CNC2CC2)o1
InChIInChI=1S/C13H20N2O4S/c16-11-5-9(6-11)7-15-20(17,18)13-4-3-12(19-13)8-14-10-1-2-10/h3-4,9-11,14-16H,1-2,5-8H2
InChIKeyPVVCRBJCCPIUEX-UHFFFAOYSA-N
MW300.38 g/mol
LogP0.58
Rot. Bonds7

About 5-[(cyclopropylamino)methyl]-N-[(3-hydroxycyclobutyl)methyl]furan-2-sulfonamide

5-[(cyclopropylamino)methyl]-N-[(3-hydroxycyclobutyl)methyl]furan-2-sulfonamide (PubChem CID 66007251) has the molecular formula C13H20N2O4S and a molecular weight of 300.38 g/mol. Its IUPAC name is 5-[(cyclopropylamino)methyl]-N-[(3-hydroxycyclobutyl)methyl]furan-2-sulfonamide.

Molecular Properties

Compound Name5-[(cyclopropylamino)methyl]-N-[(3-hydroxycyclobutyl)methyl]furan-2-sulfonamide
PubChem CID66007251
Molecular FormulaC13H20N2O4S
Molecular Weight300.38 g/mol
Exact Mass300.11
IUPAC Name5-[(cyclopropylamino)methyl]-N-[(3-hydroxycyclobutyl)methyl]furan-2-sulfonamide
SMILESO=S(=O)(NCC1CC(O)C1)c1ccc(CNC2CC2)o1
InChIInChI=1S/C13H20N2O4S/c16-11-5-9(6-11)7-15-20(17,18)13-4-3-12(19-13)8-14-10-1-2-10/h3-4,9-11,14-16H,1-2,5-8H2
InChIKeyPVVCRBJCCPIUEX-UHFFFAOYSA-N
XLogP0.58
TPSA91.57 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.38
LogP ≤ 50.58
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 5-[(cyclopropylamino)methyl]-N-[(3-hydroxycyclobutyl)methyl]furan-2-sulfonamide 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

5-[(cyclopropylamino)methyl]-N-[(3-hydroxycyclopentyl)methyl]furan-2-sulfonamide
CID 106137735
5-[(cyclopropylamino)methyl]-N-(5-hydroxypentyl)furan-2-sulfonamide
CID 107323800
N-(1-cyclopentylethyl)-5-[(cyclopropylamino)methyl]furan-2-sulfonamide
CID 106066048
5-formyl-N-[(3-hydroxycyclopentyl)methyl]furan-2-sulfonamide
CID 114148606
[5-[(cyclopropylamino)methyl]furan-2-yl]methanol
CID 20559403
5-[[(4-hydroxycyclohexyl)methylamino]methyl]-N-methylfuran-2-sulfonamide
CID 106124948
4-amino-3-fluoro-N-[(3-hydroxycyclobutyl)methyl]benzenesulfonamide
CID 82844731
5-[(cyclopropylamino)methyl]-N-(2-methyl-4-pyridinyl)furan-2-sulfonamide
CID 106071264
5-(ethylaminomethyl)-N-[(2-methylcyclopentyl)methyl]furan-2-sulfonamide
CID 107421037
5-[(cyclopropylamino)methyl]-N-(1,3-dimethylpyrazol-4-yl)furan-2-sulfonamide
CID 102807670
2-chloro-4-[(3-hydroxycyclobutyl)methylsulfamoyl]benzoic acid
CID 107090153
N-(cyclobutylmethyl)-2-[(cyclopropylamino)methyl]benzenesulfonamide
CID 106024752

Frequently Asked Questions

What is the IUPAC name of 5-[(cyclopropylamino)methyl]-N-[(3-hydroxycyclobutyl)methyl]furan-2-sulfonamide?
The IUPAC name of 5-[(cyclopropylamino)methyl]-N-[(3-hydroxycyclobutyl)methyl]furan-2-sulfonamide (CID 66007251) is 5-[(cyclopropylamino)methyl]-N-[(3-hydroxycyclobutyl)methyl]furan-2-sulfonamide.
What is the SMILES notation for 5-[(cyclopropylamino)methyl]-N-[(3-hydroxycyclobutyl)methyl]furan-2-sulfonamide?
The canonical SMILES for 5-[(cyclopropylamino)methyl]-N-[(3-hydroxycyclobutyl)methyl]furan-2-sulfonamide is O=S(=O)(NCC1CC(O)C1)c1ccc(CNC2CC2)o1.
What is the InChIKey of 5-[(cyclopropylamino)methyl]-N-[(3-hydroxycyclobutyl)methyl]furan-2-sulfonamide?
The InChIKey is PVVCRBJCCPIUEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O4S/c16-11-5-9(6-11)7-15-20(17,18)13-4-3-12(19-13)8-14-10-1-2-10/h3-4,9-11,14-16H,1-2,5-8H2.
What are the key properties of 5-[(cyclopropylamino)methyl]-N-[(3-hydroxycyclobutyl)methyl]furan-2-sulfonamide?
5-[(cyclopropylamino)methyl]-N-[(3-hydroxycyclobutyl)methyl]furan-2-sulfonamide has a molecular weight of 300.38 g/mol, XLogP of 0.58, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(cyclopropylamino)methyl]-N-[(3-hydroxycyclobutyl)methyl]furan-2-sulfonamide is sourced from PubChem (CID 66007251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).