methane;4-(2-phenylethyl)morpholine

C13H21NO — CID 143698819

IUPACmethane;4-(2-phenylethyl)morpholine
SMILESC.c1ccc(CCN2CCOCC2)cc1
InChIInChI=1S/C12H17NO.CH4/c1-2-4-12(5-3-1)6-7-13-8-10-14-11-9-13;/h1-5H,6-11H2;1H4
InChIKeyLXVQXYJCBKNFJO-UHFFFAOYSA-N
MW207.32 g/mol
LogP2.20
Rot. Bonds3

About methane;4-(2-phenylethyl)morpholine

methane;4-(2-phenylethyl)morpholine (PubChem CID 143698819) has the molecular formula C13H21NO and a molecular weight of 207.32 g/mol. Its IUPAC name is methane;4-(2-phenylethyl)morpholine.

Molecular Properties

Compound Namemethane;4-(2-phenylethyl)morpholine
PubChem CID143698819
Molecular FormulaC13H21NO
Molecular Weight207.32 g/mol
Exact Mass207.16
IUPAC Namemethane;4-(2-phenylethyl)morpholine
SMILESC.c1ccc(CCN2CCOCC2)cc1
InChIInChI=1S/C12H17NO.CH4/c1-2-4-12(5-3-1)6-7-13-8-10-14-11-9-13;/h1-5H,6-11H2;1H4
InChIKeyLXVQXYJCBKNFJO-UHFFFAOYSA-N
XLogP2.20
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 52.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of methane;4-(2-phenylethyl)morpholine?
The IUPAC name of methane;4-(2-phenylethyl)morpholine (CID 143698819) is methane;4-(2-phenylethyl)morpholine.
What is the SMILES notation for methane;4-(2-phenylethyl)morpholine?
The canonical SMILES for methane;4-(2-phenylethyl)morpholine is C.c1ccc(CCN2CCOCC2)cc1.
What is the InChIKey of methane;4-(2-phenylethyl)morpholine?
The InChIKey is LXVQXYJCBKNFJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO.CH4/c1-2-4-12(5-3-1)6-7-13-8-10-14-11-9-13;/h1-5H,6-11H2;1H4.
What are the key properties of methane;4-(2-phenylethyl)morpholine?
methane;4-(2-phenylethyl)morpholine has a molecular weight of 207.32 g/mol, XLogP of 2.20, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methane;4-(2-phenylethyl)morpholine is sourced from PubChem (CID 143698819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).