1-cyclopropyl-2-(propylsulfamoylamino)ethanol

C8H18N2O3S — CID 114809505

IUPAC1-cyclopropyl-2-(propylsulfamoylamino)ethanol
SMILESCCCNS(=O)(=O)NCC(O)C1CC1
InChIInChI=1S/C8H18N2O3S/c1-2-5-9-14(12,13)10-6-8(11)7-3-4-7/h7-11H,2-6H2,1H3
InChIKeyDSXOAWHTXICXMS-UHFFFAOYSA-N
MW222.31 g/mol
LogP-0.41
Rot. Bonds7

About 1-cyclopropyl-2-(propylsulfamoylamino)ethanol

1-cyclopropyl-2-(propylsulfamoylamino)ethanol (PubChem CID 114809505) has the molecular formula C8H18N2O3S and a molecular weight of 222.31 g/mol. Its IUPAC name is 1-cyclopropyl-2-(propylsulfamoylamino)ethanol.

Molecular Properties

Compound Name1-cyclopropyl-2-(propylsulfamoylamino)ethanol
PubChem CID114809505
Molecular FormulaC8H18N2O3S
Molecular Weight222.31 g/mol
Exact Mass222.10
IUPAC Name1-cyclopropyl-2-(propylsulfamoylamino)ethanol
SMILESCCCNS(=O)(=O)NCC(O)C1CC1
InChIInChI=1S/C8H18N2O3S/c1-2-5-9-14(12,13)10-6-8(11)7-3-4-7/h7-11H,2-6H2,1H3
InChIKeyDSXOAWHTXICXMS-UHFFFAOYSA-N
XLogP-0.41
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.31
LogP ≤ 5-0.41
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-2-(propylsulfamoylamino)ethanol?
The IUPAC name of 1-cyclopropyl-2-(propylsulfamoylamino)ethanol (CID 114809505) is 1-cyclopropyl-2-(propylsulfamoylamino)ethanol.
What is the SMILES notation for 1-cyclopropyl-2-(propylsulfamoylamino)ethanol?
The canonical SMILES for 1-cyclopropyl-2-(propylsulfamoylamino)ethanol is CCCNS(=O)(=O)NCC(O)C1CC1.
What is the InChIKey of 1-cyclopropyl-2-(propylsulfamoylamino)ethanol?
The InChIKey is DSXOAWHTXICXMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O3S/c1-2-5-9-14(12,13)10-6-8(11)7-3-4-7/h7-11H,2-6H2,1H3.
What are the key properties of 1-cyclopropyl-2-(propylsulfamoylamino)ethanol?
1-cyclopropyl-2-(propylsulfamoylamino)ethanol has a molecular weight of 222.31 g/mol, XLogP of -0.41, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-2-(propylsulfamoylamino)ethanol is sourced from PubChem (CID 114809505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).