4-morpholin-4-ylpyrrolidin-3-ol;dihydrochloride

C8H18Cl2N2O2 — CID 53398813

IUPAC4-morpholin-4-ylpyrrolidin-3-ol;dihydrochloride
SMILESCl.Cl.OC1CNCC1N1CCOCC1
InChIInChI=1S/C8H16N2O2.2ClH/c11-8-6-9-5-7(8)10-1-3-12-4-2-10;;/h7-9,11H,1-6H2;2*1H
InChIKeyFYRDBEHYFIRUNY-UHFFFAOYSA-N
MW245.15 g/mol
LogP-0.51
Rot. Bonds1

About 4-morpholin-4-ylpyrrolidin-3-ol;dihydrochloride

4-morpholin-4-ylpyrrolidin-3-ol;dihydrochloride (PubChem CID 53398813) has the molecular formula C8H18Cl2N2O2 and a molecular weight of 245.15 g/mol. Its IUPAC name is 4-morpholin-4-ylpyrrolidin-3-ol;dihydrochloride.

Molecular Properties

Compound Name4-morpholin-4-ylpyrrolidin-3-ol;dihydrochloride
PubChem CID53398813
Molecular FormulaC8H18Cl2N2O2
Molecular Weight245.15 g/mol
Exact Mass244.07
IUPAC Name4-morpholin-4-ylpyrrolidin-3-ol;dihydrochloride
SMILESCl.Cl.OC1CNCC1N1CCOCC1
InChIInChI=1S/C8H16N2O2.2ClH/c11-8-6-9-5-7(8)10-1-3-12-4-2-10;;/h7-9,11H,1-6H2;2*1H
InChIKeyFYRDBEHYFIRUNY-UHFFFAOYSA-N
XLogP-0.51
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.15
LogP ≤ 5-0.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-morpholin-4-ylpyrrolidin-3-ol;dihydrochloride?
The IUPAC name of 4-morpholin-4-ylpyrrolidin-3-ol;dihydrochloride (CID 53398813) is 4-morpholin-4-ylpyrrolidin-3-ol;dihydrochloride.
What is the SMILES notation for 4-morpholin-4-ylpyrrolidin-3-ol;dihydrochloride?
The canonical SMILES for 4-morpholin-4-ylpyrrolidin-3-ol;dihydrochloride is Cl.Cl.OC1CNCC1N1CCOCC1.
What is the InChIKey of 4-morpholin-4-ylpyrrolidin-3-ol;dihydrochloride?
The InChIKey is FYRDBEHYFIRUNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O2.2ClH/c11-8-6-9-5-7(8)10-1-3-12-4-2-10;;/h7-9,11H,1-6H2;2*1H.
What are the key properties of 4-morpholin-4-ylpyrrolidin-3-ol;dihydrochloride?
4-morpholin-4-ylpyrrolidin-3-ol;dihydrochloride has a molecular weight of 245.15 g/mol, XLogP of -0.51, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-morpholin-4-ylpyrrolidin-3-ol;dihydrochloride is sourced from PubChem (CID 53398813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).