4-[2-(4-phenyl-2-propan-2-yloxan-4-yl)ethyl]morpholine;hydrochloride

C20H32ClNO2 — CID 52994559

IUPAC4-[2-(4-phenyl-2-propan-2-yloxan-4-yl)ethyl]morpholine;hydrochloride
SMILESCC(C)C1CC(CCN2CCOCC2)(c2ccccc2)CCO1.Cl
InChIInChI=1S/C20H31NO2.ClH/c1-17(2)19-16-20(9-13-23-19,18-6-4-3-5-7-18)8-10-21-11-14-22-15-12-21;/h3-7,17,19H,8-16H2,1-2H3;1H
InChIKeyHNZPYPYXMBMVTQ-UHFFFAOYSA-N
MW353.93 g/mol
LogP3.90
Rot. Bonds5

About 4-[2-(4-phenyl-2-propan-2-yloxan-4-yl)ethyl]morpholine;hydrochloride

4-[2-(4-phenyl-2-propan-2-yloxan-4-yl)ethyl]morpholine;hydrochloride (PubChem CID 52994559) has the molecular formula C20H32ClNO2 and a molecular weight of 353.93 g/mol. Its IUPAC name is 4-[2-(4-phenyl-2-propan-2-yloxan-4-yl)ethyl]morpholine;hydrochloride.

Molecular Properties

Compound Name4-[2-(4-phenyl-2-propan-2-yloxan-4-yl)ethyl]morpholine;hydrochloride
PubChem CID52994559
Molecular FormulaC20H32ClNO2
Molecular Weight353.93 g/mol
Exact Mass353.21
IUPAC Name4-[2-(4-phenyl-2-propan-2-yloxan-4-yl)ethyl]morpholine;hydrochloride
SMILESCC(C)C1CC(CCN2CCOCC2)(c2ccccc2)CCO1.Cl
InChIInChI=1S/C20H31NO2.ClH/c1-17(2)19-16-20(9-13-23-19,18-6-4-3-5-7-18)8-10-21-11-14-22-15-12-21;/h3-7,17,19H,8-16H2,1-2H3;1H
InChIKeyHNZPYPYXMBMVTQ-UHFFFAOYSA-N
XLogP3.90
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.93
LogP ≤ 53.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

CID 93365
CID 93365
CID 54260
CID 54260
CID 91695
CID 91695
CID 54259
CID 54259
CID 11833620
CID 11833620
CID 54586690
CID 54586690
CID 137639103
CID 137639103
CID 137661600
CID 137661600
CID 16192588
CID 16192588
CID 2168
CID 2168
CID 142475195
CID 142475195
CID 120874
CID 120874

Frequently Asked Questions

What is the IUPAC name of 4-[2-(4-phenyl-2-propan-2-yloxan-4-yl)ethyl]morpholine;hydrochloride?
The IUPAC name of 4-[2-(4-phenyl-2-propan-2-yloxan-4-yl)ethyl]morpholine;hydrochloride (CID 52994559) is 4-[2-(4-phenyl-2-propan-2-yloxan-4-yl)ethyl]morpholine;hydrochloride.
What is the SMILES notation for 4-[2-(4-phenyl-2-propan-2-yloxan-4-yl)ethyl]morpholine;hydrochloride?
The canonical SMILES for 4-[2-(4-phenyl-2-propan-2-yloxan-4-yl)ethyl]morpholine;hydrochloride is CC(C)C1CC(CCN2CCOCC2)(c2ccccc2)CCO1.Cl.
What is the InChIKey of 4-[2-(4-phenyl-2-propan-2-yloxan-4-yl)ethyl]morpholine;hydrochloride?
The InChIKey is HNZPYPYXMBMVTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H31NO2.ClH/c1-17(2)19-16-20(9-13-23-19,18-6-4-3-5-7-18)8-10-21-11-14-22-15-12-21;/h3-7,17,19H,8-16H2,1-2H3;1H.
What are the key properties of 4-[2-(4-phenyl-2-propan-2-yloxan-4-yl)ethyl]morpholine;hydrochloride?
4-[2-(4-phenyl-2-propan-2-yloxan-4-yl)ethyl]morpholine;hydrochloride has a molecular weight of 353.93 g/mol, XLogP of 3.90, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(4-phenyl-2-propan-2-yloxan-4-yl)ethyl]morpholine;hydrochloride is sourced from PubChem (CID 52994559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).