1-cyclopropyl-2-(cyclopropylsulfamoylamino)ethanol

C8H16N2O3S — CID 114383309

IUPAC1-cyclopropyl-2-(cyclopropylsulfamoylamino)ethanol
SMILESO=S(=O)(NCC(O)C1CC1)NC1CC1
InChIInChI=1S/C8H16N2O3S/c11-8(6-1-2-6)5-9-14(12,13)10-7-3-4-7/h6-11H,1-5H2
InChIKeyZGPCFVUASWHMQY-UHFFFAOYSA-N
MW220.29 g/mol
LogP-0.66
Rot. Bonds6

About 1-cyclopropyl-2-(cyclopropylsulfamoylamino)ethanol

1-cyclopropyl-2-(cyclopropylsulfamoylamino)ethanol (PubChem CID 114383309) has the molecular formula C8H16N2O3S and a molecular weight of 220.29 g/mol. Its IUPAC name is 1-cyclopropyl-2-(cyclopropylsulfamoylamino)ethanol.

Molecular Properties

Compound Name1-cyclopropyl-2-(cyclopropylsulfamoylamino)ethanol
PubChem CID114383309
Molecular FormulaC8H16N2O3S
Molecular Weight220.29 g/mol
Exact Mass220.09
IUPAC Name1-cyclopropyl-2-(cyclopropylsulfamoylamino)ethanol
SMILESO=S(=O)(NCC(O)C1CC1)NC1CC1
InChIInChI=1S/C8H16N2O3S/c11-8(6-1-2-6)5-9-14(12,13)10-7-3-4-7/h6-11H,1-5H2
InChIKeyZGPCFVUASWHMQY-UHFFFAOYSA-N
XLogP-0.66
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.29
LogP ≤ 5-0.66
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-2-(cyclopropylsulfamoylamino)ethanol?
The IUPAC name of 1-cyclopropyl-2-(cyclopropylsulfamoylamino)ethanol (CID 114383309) is 1-cyclopropyl-2-(cyclopropylsulfamoylamino)ethanol.
What is the SMILES notation for 1-cyclopropyl-2-(cyclopropylsulfamoylamino)ethanol?
The canonical SMILES for 1-cyclopropyl-2-(cyclopropylsulfamoylamino)ethanol is O=S(=O)(NCC(O)C1CC1)NC1CC1.
What is the InChIKey of 1-cyclopropyl-2-(cyclopropylsulfamoylamino)ethanol?
The InChIKey is ZGPCFVUASWHMQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O3S/c11-8(6-1-2-6)5-9-14(12,13)10-7-3-4-7/h6-11H,1-5H2.
What are the key properties of 1-cyclopropyl-2-(cyclopropylsulfamoylamino)ethanol?
1-cyclopropyl-2-(cyclopropylsulfamoylamino)ethanol has a molecular weight of 220.29 g/mol, XLogP of -0.66, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-2-(cyclopropylsulfamoylamino)ethanol is sourced from PubChem (CID 114383309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).