4-(4-ethyl-4-methylhexyl)morpholine

C13H27NO — CID 134251117

IUPAC4-(4-ethyl-4-methylhexyl)morpholine
SMILESCCC(C)(CC)CCCN1CCOCC1
InChIInChI=1S/C13H27NO/c1-4-13(3,5-2)7-6-8-14-9-11-15-12-10-14/h4-12H2,1-3H3
InChIKeyOPOWLBYWIIRKIM-UHFFFAOYSA-N
MW213.36 g/mol
LogP2.93
Rot. Bonds6

About 4-(4-ethyl-4-methylhexyl)morpholine

4-(4-ethyl-4-methylhexyl)morpholine (PubChem CID 134251117) has the molecular formula C13H27NO and a molecular weight of 213.36 g/mol. Its IUPAC name is 4-(4-ethyl-4-methylhexyl)morpholine.

Molecular Properties

Compound Name4-(4-ethyl-4-methylhexyl)morpholine
PubChem CID134251117
Molecular FormulaC13H27NO
Molecular Weight213.36 g/mol
Exact Mass213.21
IUPAC Name4-(4-ethyl-4-methylhexyl)morpholine
SMILESCCC(C)(CC)CCCN1CCOCC1
InChIInChI=1S/C13H27NO/c1-4-13(3,5-2)7-6-8-14-9-11-15-12-10-14/h4-12H2,1-3H3
InChIKeyOPOWLBYWIIRKIM-UHFFFAOYSA-N
XLogP2.93
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.36
LogP ≤ 52.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2,2-dimethyl-5-morpholin-4-ylpentanoic acid
CID 65254938
butane;4-butylmorpholine
CID 177152600
4-hexylmorpholine
CID 3614751
3-(4-ethyl-4-methylhexyl)-1,3-thiazolidine
CID 134441587
2-methyl-4-morpholin-4-ylbutan-2-ol
CID 79316740
16-[10-(1,4,7,10,13-pentaoxa-16-azacyclooctadec-16-yl)decyl]-1,4,7,10,13-pentaoxa-16-azacyclooctadecane
CID 15145347
2,2-dimethyl-6-morpholin-4-ylhexanoic acid
CID 106713869
1-ethyl-4-(3-ethyl-3-methylpentyl)piperazine
CID 134441401
4-(3-ethoxy-3-methylbutyl)morpholine
CID 167018299
16-propyl-1,4,7,10,13-pentaoxa-16-azacyclooctadecane
CID 71337150
ethane;4-propylmorpholine
CID 143004992
4-propylmorpholine;hydrobromide
CID 70540609

Frequently Asked Questions

What is the IUPAC name of 4-(4-ethyl-4-methylhexyl)morpholine?
The IUPAC name of 4-(4-ethyl-4-methylhexyl)morpholine (CID 134251117) is 4-(4-ethyl-4-methylhexyl)morpholine.
What is the SMILES notation for 4-(4-ethyl-4-methylhexyl)morpholine?
The canonical SMILES for 4-(4-ethyl-4-methylhexyl)morpholine is CCC(C)(CC)CCCN1CCOCC1.
What is the InChIKey of 4-(4-ethyl-4-methylhexyl)morpholine?
The InChIKey is OPOWLBYWIIRKIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27NO/c1-4-13(3,5-2)7-6-8-14-9-11-15-12-10-14/h4-12H2,1-3H3.
What are the key properties of 4-(4-ethyl-4-methylhexyl)morpholine?
4-(4-ethyl-4-methylhexyl)morpholine has a molecular weight of 213.36 g/mol, XLogP of 2.93, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-ethyl-4-methylhexyl)morpholine is sourced from PubChem (CID 134251117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).