4-(3-chlorophenyl)-2-methylmorpholine

C11H14ClNO — CID 170319463

IUPAC4-(3-chlorophenyl)-2-methylmorpholine
SMILESCC1CN(c2cccc(Cl)c2)CCO1
InChIInChI=1S/C11H14ClNO/c1-9-8-13(5-6-14-9)11-4-2-3-10(12)7-11/h2-4,7,9H,5-6,8H2,1H3
InChIKeyXGTOBJKGWNIKEE-UHFFFAOYSA-N
MW211.69 g/mol
LogP2.57
Rot. Bonds1

About 4-(3-chlorophenyl)-2-methylmorpholine

4-(3-chlorophenyl)-2-methylmorpholine (PubChem CID 170319463) has the molecular formula C11H14ClNO and a molecular weight of 211.69 g/mol. Its IUPAC name is 4-(3-chlorophenyl)-2-methylmorpholine.

Molecular Properties

Compound Name4-(3-chlorophenyl)-2-methylmorpholine
PubChem CID170319463
Molecular FormulaC11H14ClNO
Molecular Weight211.69 g/mol
Exact Mass211.08
IUPAC Name4-(3-chlorophenyl)-2-methylmorpholine
SMILESCC1CN(c2cccc(Cl)c2)CCO1
InChIInChI=1S/C11H14ClNO/c1-9-8-13(5-6-14-9)11-4-2-3-10(12)7-11/h2-4,7,9H,5-6,8H2,1H3
InChIKeyXGTOBJKGWNIKEE-UHFFFAOYSA-N
XLogP2.57
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.69
LogP ≤ 52.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-chloro-4-(2-methylmorpholin-4-yl)benzoic acid
CID 62946063
(3R)-1-(3-chlorophenyl)-3-methylpiperazine
CID 10822374
4-chloro-2-(2-methylmorpholin-4-yl)aniline
CID 115468437
5-chloro-2-(2-methylmorpholin-4-yl)aniline
CID 16772686
4-(3-chloro-2-nitrophenyl)-2-methylmorpholine
CID 104838773
1-[2-amino-4-(2-methylmorpholin-4-yl)phenyl]ethanone
CID 104528165
3-amino-6-(2-methylmorpholin-4-yl)-1,3-dihydroindol-2-one
CID 43586561
2-methyl-4-(4-nitrophenyl)morpholine
CID 71113420
2-chloro-N-[4-(2-methylmorpholin-4-yl)phenyl]benzamide
CID 110637279
[2-fluoro-4-(2-methylmorpholin-4-yl)phenyl]methanamine
CID 115366639
2,6-difluoro-4-[(2S)-2-methylmorpholin-4-yl]benzoic acid
CID 146567123
1-(3-chlorophenyl)azonane
CID 145391535

Frequently Asked Questions

What is the IUPAC name of 4-(3-chlorophenyl)-2-methylmorpholine?
The IUPAC name of 4-(3-chlorophenyl)-2-methylmorpholine (CID 170319463) is 4-(3-chlorophenyl)-2-methylmorpholine.
What is the SMILES notation for 4-(3-chlorophenyl)-2-methylmorpholine?
The canonical SMILES for 4-(3-chlorophenyl)-2-methylmorpholine is CC1CN(c2cccc(Cl)c2)CCO1.
What is the InChIKey of 4-(3-chlorophenyl)-2-methylmorpholine?
The InChIKey is XGTOBJKGWNIKEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14ClNO/c1-9-8-13(5-6-14-9)11-4-2-3-10(12)7-11/h2-4,7,9H,5-6,8H2,1H3.
What are the key properties of 4-(3-chlorophenyl)-2-methylmorpholine?
4-(3-chlorophenyl)-2-methylmorpholine has a molecular weight of 211.69 g/mol, XLogP of 2.57, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-chlorophenyl)-2-methylmorpholine is sourced from PubChem (CID 170319463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).