4-pyrrolidin-3-ylmorpholine;hydrochloride

C8H17ClN2O — CID 53442929

IUPAC4-pyrrolidin-3-ylmorpholine;hydrochloride
SMILESC1CC(N2CCOCC2)CN1.Cl
InChIInChI=1S/C8H16N2O.ClH/c1-2-9-7-8(1)10-3-5-11-6-4-10;/h8-9H,1-7H2;1H
InChIKeyNYWPZMNBIBFPQE-UHFFFAOYSA-N
MW192.69 g/mol
LogP0.10
Rot. Bonds1

About 4-pyrrolidin-3-ylmorpholine;hydrochloride

4-pyrrolidin-3-ylmorpholine;hydrochloride (PubChem CID 53442929) has the molecular formula C8H17ClN2O and a molecular weight of 192.69 g/mol. Its IUPAC name is 4-pyrrolidin-3-ylmorpholine;hydrochloride.

Molecular Properties

Compound Name4-pyrrolidin-3-ylmorpholine;hydrochloride
PubChem CID53442929
Molecular FormulaC8H17ClN2O
Molecular Weight192.69 g/mol
Exact Mass192.10
IUPAC Name4-pyrrolidin-3-ylmorpholine;hydrochloride
SMILESC1CC(N2CCOCC2)CN1.Cl
InChIInChI=1S/C8H16N2O.ClH/c1-2-9-7-8(1)10-3-5-11-6-4-10;/h8-9H,1-7H2;1H
InChIKeyNYWPZMNBIBFPQE-UHFFFAOYSA-N
XLogP0.10
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.69
LogP ≤ 50.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-pyrrolidin-3-ylmorpholine;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-pyrrolidin-3-ylmorpholine;hydrochloride?
The IUPAC name of 4-pyrrolidin-3-ylmorpholine;hydrochloride (CID 53442929) is 4-pyrrolidin-3-ylmorpholine;hydrochloride.
What is the SMILES notation for 4-pyrrolidin-3-ylmorpholine;hydrochloride?
The canonical SMILES for 4-pyrrolidin-3-ylmorpholine;hydrochloride is C1CC(N2CCOCC2)CN1.Cl.
What is the InChIKey of 4-pyrrolidin-3-ylmorpholine;hydrochloride?
The InChIKey is NYWPZMNBIBFPQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O.ClH/c1-2-9-7-8(1)10-3-5-11-6-4-10;/h8-9H,1-7H2;1H.
What are the key properties of 4-pyrrolidin-3-ylmorpholine;hydrochloride?
4-pyrrolidin-3-ylmorpholine;hydrochloride has a molecular weight of 192.69 g/mol, XLogP of 0.10, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-pyrrolidin-3-ylmorpholine;hydrochloride is sourced from PubChem (CID 53442929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).