4-[(4-ethyl-3-methylphenyl)methyl]morpholine

C14H21NO — CID 71052307

IUPAC4-[(4-ethyl-3-methylphenyl)methyl]morpholine
SMILESCCc1ccc(CN2CCOCC2)cc1C
InChIInChI=1S/C14H21NO/c1-3-14-5-4-13(10-12(14)2)11-15-6-8-16-9-7-15/h4-5,10H,3,6-9,11H2,1-2H3
InChIKeyVKOLWVWTODTIEQ-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.39
Rot. Bonds3

About 4-[(4-ethyl-3-methylphenyl)methyl]morpholine

4-[(4-ethyl-3-methylphenyl)methyl]morpholine (PubChem CID 71052307) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is 4-[(4-ethyl-3-methylphenyl)methyl]morpholine.

Molecular Properties

Compound Name4-[(4-ethyl-3-methylphenyl)methyl]morpholine
PubChem CID71052307
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name4-[(4-ethyl-3-methylphenyl)methyl]morpholine
SMILESCCc1ccc(CN2CCOCC2)cc1C
InChIInChI=1S/C14H21NO/c1-3-14-5-4-13(10-12(14)2)11-15-6-8-16-9-7-15/h4-5,10H,3,6-9,11H2,1-2H3
InChIKeyVKOLWVWTODTIEQ-UHFFFAOYSA-N
XLogP2.39
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-[[2-methyl-4-(morpholin-4-ylmethyl)phenyl]methyl]pyrazole-4-carboxamide
CID 174752138
4-(4-ethyl-3-methylphenyl)morpholine
CID 71052308
2-methyl-5-(morpholin-4-ylmethyl)benzenesulfonyl chloride
CID 83271462
4-[(4-bromo-3,5-dimethylphenyl)methyl]morpholine
CID 170919244
2-methyl-5-(1,4-oxazepan-4-ylmethyl)aniline
CID 62972113
[2-ethoxy-4-(morpholin-4-ylmethyl)phenyl]methanamine
CID 84754907
1-[(3,4-diethylphenyl)methyl]pyrrolidine
CID 170618261
4-[[4-ethyl-2-(trifluoromethyl)phenyl]methyl]morpholine
CID 157042080
4-[[4-(2,2-dimethylpropyl)phenyl]methyl]morpholine
CID 59743834
N-[(4-methoxy-3,5-dimethylphenyl)methyl]-1-[4-(morpholin-4-ylmethyl)phenyl]methanamine
CID 86843039
(2,4-dimethylphenyl)-[4-(morpholin-4-ylmethyl)phenyl]methanone
CID 24724237
2-amino-N-[2-methyl-5-(morpholin-4-ylmethyl)phenyl]pentanamide
CID 119890389

Frequently Asked Questions

What is the IUPAC name of 4-[(4-ethyl-3-methylphenyl)methyl]morpholine?
The IUPAC name of 4-[(4-ethyl-3-methylphenyl)methyl]morpholine (CID 71052307) is 4-[(4-ethyl-3-methylphenyl)methyl]morpholine.
What is the SMILES notation for 4-[(4-ethyl-3-methylphenyl)methyl]morpholine?
The canonical SMILES for 4-[(4-ethyl-3-methylphenyl)methyl]morpholine is CCc1ccc(CN2CCOCC2)cc1C.
What is the InChIKey of 4-[(4-ethyl-3-methylphenyl)methyl]morpholine?
The InChIKey is VKOLWVWTODTIEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-3-14-5-4-13(10-12(14)2)11-15-6-8-16-9-7-15/h4-5,10H,3,6-9,11H2,1-2H3.
What are the key properties of 4-[(4-ethyl-3-methylphenyl)methyl]morpholine?
4-[(4-ethyl-3-methylphenyl)methyl]morpholine has a molecular weight of 219.33 g/mol, XLogP of 2.39, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-ethyl-3-methylphenyl)methyl]morpholine is sourced from PubChem (CID 71052307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).