2-methoxy-4-morpholin-4-ylaniline;hydrochloride

C11H17ClN2O2 — CID 21144261

IUPAC2-methoxy-4-morpholin-4-ylaniline;hydrochloride
SMILESCOc1cc(N2CCOCC2)ccc1N.Cl
InChIInChI=1S/C11H16N2O2.ClH/c1-14-11-8-9(2-3-10(11)12)13-4-6-15-7-5-13;/h2-3,8H,4-7,12H2,1H3;1H
InChIKeyFNXJBLQCWDUTFN-UHFFFAOYSA-N
MW244.72 g/mol
LogP1.54
Rot. Bonds2

About 2-methoxy-4-morpholin-4-ylaniline;hydrochloride

2-methoxy-4-morpholin-4-ylaniline;hydrochloride (PubChem CID 21144261) has the molecular formula C11H17ClN2O2 and a molecular weight of 244.72 g/mol. Its IUPAC name is 2-methoxy-4-morpholin-4-ylaniline;hydrochloride.

Molecular Properties

Compound Name2-methoxy-4-morpholin-4-ylaniline;hydrochloride
PubChem CID21144261
Molecular FormulaC11H17ClN2O2
Molecular Weight244.72 g/mol
Exact Mass244.10
IUPAC Name2-methoxy-4-morpholin-4-ylaniline;hydrochloride
SMILESCOc1cc(N2CCOCC2)ccc1N.Cl
InChIInChI=1S/C11H16N2O2.ClH/c1-14-11-8-9(2-3-10(11)12)13-4-6-15-7-5-13;/h2-3,8H,4-7,12H2,1H3;1H
InChIKeyFNXJBLQCWDUTFN-UHFFFAOYSA-N
XLogP1.54
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.72
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

Analyze 2-methoxy-4-morpholin-4-ylaniline;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 2-methoxy-4-morpholin-4-ylaniline;hydrochloride?
The IUPAC name of 2-methoxy-4-morpholin-4-ylaniline;hydrochloride (CID 21144261) is 2-methoxy-4-morpholin-4-ylaniline;hydrochloride.
What is the SMILES notation for 2-methoxy-4-morpholin-4-ylaniline;hydrochloride?
The canonical SMILES for 2-methoxy-4-morpholin-4-ylaniline;hydrochloride is COc1cc(N2CCOCC2)ccc1N.Cl.
What is the InChIKey of 2-methoxy-4-morpholin-4-ylaniline;hydrochloride?
The InChIKey is FNXJBLQCWDUTFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2.ClH/c1-14-11-8-9(2-3-10(11)12)13-4-6-15-7-5-13;/h2-3,8H,4-7,12H2,1H3;1H.
What are the key properties of 2-methoxy-4-morpholin-4-ylaniline;hydrochloride?
2-methoxy-4-morpholin-4-ylaniline;hydrochloride has a molecular weight of 244.72 g/mol, XLogP of 1.54, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-4-morpholin-4-ylaniline;hydrochloride is sourced from PubChem (CID 21144261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).