4-[(2-chlorophenyl)methyl]morpholine

C11H14ClNO — CID 782978

IUPAC4-[(2-chlorophenyl)methyl]morpholine
SMILESClc1ccccc1CN1CCOCC1
InChIInChI=1S/C11H14ClNO/c12-11-4-2-1-3-10(11)9-13-5-7-14-8-6-13/h1-4H,5-9H2
InChIKeyOPXOMKDSNYMMTQ-UHFFFAOYSA-N
MW211.69 g/mol
LogP2.17
Rot. Bonds2

About 4-[(2-chlorophenyl)methyl]morpholine

4-[(2-chlorophenyl)methyl]morpholine (PubChem CID 782978) has the molecular formula C11H14ClNO and a molecular weight of 211.69 g/mol. Its IUPAC name is 4-[(2-chlorophenyl)methyl]morpholine.

Molecular Properties

Compound Name4-[(2-chlorophenyl)methyl]morpholine
PubChem CID782978
Molecular FormulaC11H14ClNO
Molecular Weight211.69 g/mol
Exact Mass211.08
IUPAC Name4-[(2-chlorophenyl)methyl]morpholine
SMILESClc1ccccc1CN1CCOCC1
InChIInChI=1S/C11H14ClNO/c12-11-4-2-1-3-10(11)9-13-5-7-14-8-6-13/h1-4H,5-9H2
InChIKeyOPXOMKDSNYMMTQ-UHFFFAOYSA-N
XLogP2.17
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.69
LogP ≤ 52.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-[(2-chlorophenyl)methyl]morpholine?
The IUPAC name of 4-[(2-chlorophenyl)methyl]morpholine (CID 782978) is 4-[(2-chlorophenyl)methyl]morpholine.
What is the SMILES notation for 4-[(2-chlorophenyl)methyl]morpholine?
The canonical SMILES for 4-[(2-chlorophenyl)methyl]morpholine is Clc1ccccc1CN1CCOCC1.
What is the InChIKey of 4-[(2-chlorophenyl)methyl]morpholine?
The InChIKey is OPXOMKDSNYMMTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14ClNO/c12-11-4-2-1-3-10(11)9-13-5-7-14-8-6-13/h1-4H,5-9H2.
What are the key properties of 4-[(2-chlorophenyl)methyl]morpholine?
4-[(2-chlorophenyl)methyl]morpholine has a molecular weight of 211.69 g/mol, XLogP of 2.17, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-chlorophenyl)methyl]morpholine is sourced from PubChem (CID 782978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).