1-cyclopropyl-2-(2-methylpropylsulfamoylamino)ethanol

C9H20N2O3S — CID 114815667

IUPAC1-cyclopropyl-2-(2-methylpropylsulfamoylamino)ethanol
SMILESCC(C)CNS(=O)(=O)NCC(O)C1CC1
InChIInChI=1S/C9H20N2O3S/c1-7(2)5-10-15(13,14)11-6-9(12)8-3-4-8/h7-12H,3-6H2,1-2H3
InChIKeySEQAZGFPNZUNRY-UHFFFAOYSA-N
MW236.34 g/mol
LogP-0.16
Rot. Bonds7

About 1-cyclopropyl-2-(2-methylpropylsulfamoylamino)ethanol

1-cyclopropyl-2-(2-methylpropylsulfamoylamino)ethanol (PubChem CID 114815667) has the molecular formula C9H20N2O3S and a molecular weight of 236.34 g/mol. Its IUPAC name is 1-cyclopropyl-2-(2-methylpropylsulfamoylamino)ethanol.

Molecular Properties

Compound Name1-cyclopropyl-2-(2-methylpropylsulfamoylamino)ethanol
PubChem CID114815667
Molecular FormulaC9H20N2O3S
Molecular Weight236.34 g/mol
Exact Mass236.12
IUPAC Name1-cyclopropyl-2-(2-methylpropylsulfamoylamino)ethanol
SMILESCC(C)CNS(=O)(=O)NCC(O)C1CC1
InChIInChI=1S/C9H20N2O3S/c1-7(2)5-10-15(13,14)11-6-9(12)8-3-4-8/h7-12H,3-6H2,1-2H3
InChIKeySEQAZGFPNZUNRY-UHFFFAOYSA-N
XLogP-0.16
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.34
LogP ≤ 5-0.16
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-2-(2-methylpropylsulfamoylamino)ethanol?
The IUPAC name of 1-cyclopropyl-2-(2-methylpropylsulfamoylamino)ethanol (CID 114815667) is 1-cyclopropyl-2-(2-methylpropylsulfamoylamino)ethanol.
What is the SMILES notation for 1-cyclopropyl-2-(2-methylpropylsulfamoylamino)ethanol?
The canonical SMILES for 1-cyclopropyl-2-(2-methylpropylsulfamoylamino)ethanol is CC(C)CNS(=O)(=O)NCC(O)C1CC1.
What is the InChIKey of 1-cyclopropyl-2-(2-methylpropylsulfamoylamino)ethanol?
The InChIKey is SEQAZGFPNZUNRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O3S/c1-7(2)5-10-15(13,14)11-6-9(12)8-3-4-8/h7-12H,3-6H2,1-2H3.
What are the key properties of 1-cyclopropyl-2-(2-methylpropylsulfamoylamino)ethanol?
1-cyclopropyl-2-(2-methylpropylsulfamoylamino)ethanol has a molecular weight of 236.34 g/mol, XLogP of -0.16, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-2-(2-methylpropylsulfamoylamino)ethanol is sourced from PubChem (CID 114815667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).