ethane;(3-propylthiomorpholin-2-yl)methanol

C10H23NOS — CID 143180579

IUPACethane;(3-propylthiomorpholin-2-yl)methanol
SMILESCC.CCCC1NCCSC1CO
InChIInChI=1S/C8H17NOS.C2H6/c1-2-3-7-8(6-10)11-5-4-9-7;1-2/h7-10H,2-6H2,1H3;1-2H3
InChIKeyCXDVAHAGUSBNNQ-UHFFFAOYSA-N
MW205.37 g/mol
LogP1.88
Rot. Bonds3

About ethane;(3-propylthiomorpholin-2-yl)methanol

ethane;(3-propylthiomorpholin-2-yl)methanol (PubChem CID 143180579) has the molecular formula C10H23NOS and a molecular weight of 205.37 g/mol. Its IUPAC name is ethane;(3-propylthiomorpholin-2-yl)methanol.

Molecular Properties

Compound Nameethane;(3-propylthiomorpholin-2-yl)methanol
PubChem CID143180579
Molecular FormulaC10H23NOS
Molecular Weight205.37 g/mol
Exact Mass205.15
IUPAC Nameethane;(3-propylthiomorpholin-2-yl)methanol
SMILESCC.CCCC1NCCSC1CO
InChIInChI=1S/C8H17NOS.C2H6/c1-2-3-7-8(6-10)11-5-4-9-7;1-2/h7-10H,2-6H2,1H3;1-2H3
InChIKeyCXDVAHAGUSBNNQ-UHFFFAOYSA-N
XLogP1.88
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.37
LogP ≤ 51.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of ethane;(3-propylthiomorpholin-2-yl)methanol?
The IUPAC name of ethane;(3-propylthiomorpholin-2-yl)methanol (CID 143180579) is ethane;(3-propylthiomorpholin-2-yl)methanol.
What is the SMILES notation for ethane;(3-propylthiomorpholin-2-yl)methanol?
The canonical SMILES for ethane;(3-propylthiomorpholin-2-yl)methanol is CC.CCCC1NCCSC1CO.
What is the InChIKey of ethane;(3-propylthiomorpholin-2-yl)methanol?
The InChIKey is CXDVAHAGUSBNNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NOS.C2H6/c1-2-3-7-8(6-10)11-5-4-9-7;1-2/h7-10H,2-6H2,1H3;1-2H3.
What are the key properties of ethane;(3-propylthiomorpholin-2-yl)methanol?
ethane;(3-propylthiomorpholin-2-yl)methanol has a molecular weight of 205.37 g/mol, XLogP of 1.88, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;(3-propylthiomorpholin-2-yl)methanol is sourced from PubChem (CID 143180579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).