4-phenylmorpholine;hydrochloride

C10H14ClNO — CID 3014252

IUPAC4-phenylmorpholine;hydrochloride
SMILESCl.c1ccc(N2CCOCC2)cc1
InChIInChI=1S/C10H13NO.ClH/c1-2-4-10(5-3-1)11-6-8-12-9-7-11;/h1-5H,6-9H2;1H
InChIKeyOJTANAMJGXNZOK-UHFFFAOYSA-N
MW199.68 g/mol
LogP1.95
Rot. Bonds1

About 4-phenylmorpholine;hydrochloride

4-phenylmorpholine;hydrochloride (PubChem CID 3014252) has the molecular formula C10H14ClNO and a molecular weight of 199.68 g/mol. Its IUPAC name is 4-phenylmorpholine;hydrochloride.

Molecular Properties

Compound Name4-phenylmorpholine;hydrochloride
PubChem CID3014252
Molecular FormulaC10H14ClNO
Molecular Weight199.68 g/mol
Exact Mass199.08
IUPAC Name4-phenylmorpholine;hydrochloride
SMILESCl.c1ccc(N2CCOCC2)cc1
InChIInChI=1S/C10H13NO.ClH/c1-2-4-10(5-3-1)11-6-8-12-9-7-11;/h1-5H,6-9H2;1H
InChIKeyOJTANAMJGXNZOK-UHFFFAOYSA-N
XLogP1.95
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.68
LogP ≤ 51.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-phenylmorpholine;hydrochloride?
The IUPAC name of 4-phenylmorpholine;hydrochloride (CID 3014252) is 4-phenylmorpholine;hydrochloride.
What is the SMILES notation for 4-phenylmorpholine;hydrochloride?
The canonical SMILES for 4-phenylmorpholine;hydrochloride is Cl.c1ccc(N2CCOCC2)cc1.
What is the InChIKey of 4-phenylmorpholine;hydrochloride?
The InChIKey is OJTANAMJGXNZOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO.ClH/c1-2-4-10(5-3-1)11-6-8-12-9-7-11;/h1-5H,6-9H2;1H.
What are the key properties of 4-phenylmorpholine;hydrochloride?
4-phenylmorpholine;hydrochloride has a molecular weight of 199.68 g/mol, XLogP of 1.95, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenylmorpholine;hydrochloride is sourced from PubChem (CID 3014252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).