4-[2-[bis(4-chlorophenyl)methoxy]ethyl]morpholine;hydrochloride

C19H22Cl3NO2 — CID 3047883

IUPAC4-[2-[bis(4-chlorophenyl)methoxy]ethyl]morpholine;hydrochloride
SMILESCl.Clc1ccc(C(OCCN2CCOCC2)c2ccc(Cl)cc2)cc1
InChIInChI=1S/C19H21Cl2NO2.ClH/c20-17-5-1-15(2-6-17)19(16-3-7-18(21)8-4-16)24-14-11-22-9-12-23-13-10-22;/h1-8,19H,9-14H2;1H
InChIKeyKEXKFPQNPKAROD-UHFFFAOYSA-N
MW402.75 g/mol
LogP4.85
Rot. Bonds6

About 4-[2-[bis(4-chlorophenyl)methoxy]ethyl]morpholine;hydrochloride

4-[2-[bis(4-chlorophenyl)methoxy]ethyl]morpholine;hydrochloride (PubChem CID 3047883) has the molecular formula C19H22Cl3NO2 and a molecular weight of 402.75 g/mol. Its IUPAC name is 4-[2-[bis(4-chlorophenyl)methoxy]ethyl]morpholine;hydrochloride.

Molecular Properties

Compound Name4-[2-[bis(4-chlorophenyl)methoxy]ethyl]morpholine;hydrochloride
PubChem CID3047883
Molecular FormulaC19H22Cl3NO2
Molecular Weight402.75 g/mol
Exact Mass401.07
IUPAC Name4-[2-[bis(4-chlorophenyl)methoxy]ethyl]morpholine;hydrochloride
SMILESCl.Clc1ccc(C(OCCN2CCOCC2)c2ccc(Cl)cc2)cc1
InChIInChI=1S/C19H21Cl2NO2.ClH/c20-17-5-1-15(2-6-17)19(16-3-7-18(21)8-4-16)24-14-11-22-9-12-23-13-10-22;/h1-8,19H,9-14H2;1H
InChIKeyKEXKFPQNPKAROD-UHFFFAOYSA-N
XLogP4.85
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.75
LogP ≤ 54.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 4-[2-[bis(4-chlorophenyl)methoxy]ethyl]morpholine;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-[2-[bis(4-chlorophenyl)methoxy]ethyl]morpholine;hydrochloride?
The IUPAC name of 4-[2-[bis(4-chlorophenyl)methoxy]ethyl]morpholine;hydrochloride (CID 3047883) is 4-[2-[bis(4-chlorophenyl)methoxy]ethyl]morpholine;hydrochloride.
What is the SMILES notation for 4-[2-[bis(4-chlorophenyl)methoxy]ethyl]morpholine;hydrochloride?
The canonical SMILES for 4-[2-[bis(4-chlorophenyl)methoxy]ethyl]morpholine;hydrochloride is Cl.Clc1ccc(C(OCCN2CCOCC2)c2ccc(Cl)cc2)cc1.
What is the InChIKey of 4-[2-[bis(4-chlorophenyl)methoxy]ethyl]morpholine;hydrochloride?
The InChIKey is KEXKFPQNPKAROD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21Cl2NO2.ClH/c20-17-5-1-15(2-6-17)19(16-3-7-18(21)8-4-16)24-14-11-22-9-12-23-13-10-22;/h1-8,19H,9-14H2;1H.
What are the key properties of 4-[2-[bis(4-chlorophenyl)methoxy]ethyl]morpholine;hydrochloride?
4-[2-[bis(4-chlorophenyl)methoxy]ethyl]morpholine;hydrochloride has a molecular weight of 402.75 g/mol, XLogP of 4.85, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[bis(4-chlorophenyl)methoxy]ethyl]morpholine;hydrochloride is sourced from PubChem (CID 3047883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).