1-methyl-4-morpholin-4-ylpyrrolidin-3-ol

C9H18N2O2 — CID 123269721

IUPAC1-methyl-4-morpholin-4-ylpyrrolidin-3-ol
SMILESCN1CC(O)C(N2CCOCC2)C1
InChIInChI=1S/C9H18N2O2/c1-10-6-8(9(12)7-10)11-2-4-13-5-3-11/h8-9,12H,2-7H2,1H3
InChIKeyFWBFZJJWASBUPJ-UHFFFAOYSA-N
MW186.25 g/mol
LogP-1.01
Rot. Bonds1

About 1-methyl-4-morpholin-4-ylpyrrolidin-3-ol

1-methyl-4-morpholin-4-ylpyrrolidin-3-ol (PubChem CID 123269721) has the molecular formula C9H18N2O2 and a molecular weight of 186.25 g/mol. Its IUPAC name is 1-methyl-4-morpholin-4-ylpyrrolidin-3-ol.

Molecular Properties

Compound Name1-methyl-4-morpholin-4-ylpyrrolidin-3-ol
PubChem CID123269721
Molecular FormulaC9H18N2O2
Molecular Weight186.25 g/mol
Exact Mass186.14
IUPAC Name1-methyl-4-morpholin-4-ylpyrrolidin-3-ol
SMILESCN1CC(O)C(N2CCOCC2)C1
InChIInChI=1S/C9H18N2O2/c1-10-6-8(9(12)7-10)11-2-4-13-5-3-11/h8-9,12H,2-7H2,1H3
InChIKeyFWBFZJJWASBUPJ-UHFFFAOYSA-N
XLogP-1.01
TPSA35.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 5-1.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-morpholin-4-ylpyrrolidin-3-ol?
The IUPAC name of 1-methyl-4-morpholin-4-ylpyrrolidin-3-ol (CID 123269721) is 1-methyl-4-morpholin-4-ylpyrrolidin-3-ol.
What is the SMILES notation for 1-methyl-4-morpholin-4-ylpyrrolidin-3-ol?
The canonical SMILES for 1-methyl-4-morpholin-4-ylpyrrolidin-3-ol is CN1CC(O)C(N2CCOCC2)C1.
What is the InChIKey of 1-methyl-4-morpholin-4-ylpyrrolidin-3-ol?
The InChIKey is FWBFZJJWASBUPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O2/c1-10-6-8(9(12)7-10)11-2-4-13-5-3-11/h8-9,12H,2-7H2,1H3.
What are the key properties of 1-methyl-4-morpholin-4-ylpyrrolidin-3-ol?
1-methyl-4-morpholin-4-ylpyrrolidin-3-ol has a molecular weight of 186.25 g/mol, XLogP of -1.01, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-morpholin-4-ylpyrrolidin-3-ol is sourced from PubChem (CID 123269721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).