2-(4-chlorophenyl)morpholine

C10H12ClNO — CID 5154931

IUPAC2-(4-chlorophenyl)morpholine
SMILESClc1ccc(C2CNCCO2)cc1
InChIInChI=1S/C10H12ClNO/c11-9-3-1-8(2-4-9)10-7-12-5-6-13-10/h1-4,10,12H,5-7H2
InChIKeyANGMDOVGFNZDLQ-UHFFFAOYSA-N
MW197.67 g/mol
LogP2.00
Rot. Bonds1

About 2-(4-chlorophenyl)morpholine

2-(4-chlorophenyl)morpholine (PubChem CID 5154931) has the molecular formula C10H12ClNO and a molecular weight of 197.67 g/mol. Its IUPAC name is 2-(4-chlorophenyl)morpholine.

Molecular Properties

Compound Name2-(4-chlorophenyl)morpholine
PubChem CID5154931
Molecular FormulaC10H12ClNO
Molecular Weight197.67 g/mol
Exact Mass197.06
IUPAC Name2-(4-chlorophenyl)morpholine
SMILESClc1ccc(C2CNCCO2)cc1
InChIInChI=1S/C10H12ClNO/c11-9-3-1-8(2-4-9)10-7-12-5-6-13-10/h1-4,10,12H,5-7H2
InChIKeyANGMDOVGFNZDLQ-UHFFFAOYSA-N
XLogP2.00
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.67
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)morpholine?
The IUPAC name of 2-(4-chlorophenyl)morpholine (CID 5154931) is 2-(4-chlorophenyl)morpholine.
What is the SMILES notation for 2-(4-chlorophenyl)morpholine?
The canonical SMILES for 2-(4-chlorophenyl)morpholine is Clc1ccc(C2CNCCO2)cc1.
What is the InChIKey of 2-(4-chlorophenyl)morpholine?
The InChIKey is ANGMDOVGFNZDLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12ClNO/c11-9-3-1-8(2-4-9)10-7-12-5-6-13-10/h1-4,10,12H,5-7H2.
What are the key properties of 2-(4-chlorophenyl)morpholine?
2-(4-chlorophenyl)morpholine has a molecular weight of 197.67 g/mol, XLogP of 2.00, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)morpholine is sourced from PubChem (CID 5154931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).