4-(5-methyldodecan-5-yl)morpholine

C17H35NO — CID 138551223

IUPAC4-(5-methyldodecan-5-yl)morpholine
SMILESCCCCCCCC(C)(CCCC)N1CCOCC1
InChIInChI=1S/C17H35NO/c1-4-6-8-9-10-12-17(3,11-7-5-2)18-13-15-19-16-14-18/h4-16H2,1-3H3
InChIKeySOYYUYFZOJSFTH-UHFFFAOYSA-N
MW269.47 g/mol
LogP4.63
Rot. Bonds10

About 4-(5-methyldodecan-5-yl)morpholine

4-(5-methyldodecan-5-yl)morpholine (PubChem CID 138551223) has the molecular formula C17H35NO and a molecular weight of 269.47 g/mol. Its IUPAC name is 4-(5-methyldodecan-5-yl)morpholine.

Molecular Properties

Compound Name4-(5-methyldodecan-5-yl)morpholine
PubChem CID138551223
Molecular FormulaC17H35NO
Molecular Weight269.47 g/mol
Exact Mass269.27
IUPAC Name4-(5-methyldodecan-5-yl)morpholine
SMILESCCCCCCCC(C)(CCCC)N1CCOCC1
InChIInChI=1S/C17H35NO/c1-4-6-8-9-10-12-17(3,11-7-5-2)18-13-15-19-16-14-18/h4-16H2,1-3H3
InChIKeySOYYUYFZOJSFTH-UHFFFAOYSA-N
XLogP4.63
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.47
LogP ≤ 54.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-(7-methyltridecan-7-yl)pyrrolidine
CID 131990775
4-[(E)-2,2,5-trimethylundec-3-en-5-yl]morpholine
CID 11808124
1-methyl-4-(6-methylundecan-6-yl)piperazine
CID 170232998
1-(7-methyltetradecan-7-yl)-1,3-diazetidine
CID 139436879
2-morpholin-4-yloctane-1,2-diol
CID 70461698
2-methyl-2-morpholin-4-ylpentan-1-amine
CID 24706216
2-methyl-2-(3-morpholin-4-ylpyrrolidin-1-yl)octan-1-amine
CID 63169684
3-methyl-1-(5-methyldodecan-5-yl)azetidin-3-ol
CID 139320078
3-methyl-3-morpholin-4-yldecan-4-one
CID 79065458
1-(6-methyldodecan-6-yl)azetidin-3-amine
CID 130337700
2-methyl-2-(2-methylmorpholin-4-yl)nonan-1-amine
CID 43130140
1,4-dioxane;tetradecane
CID 159034856

Frequently Asked Questions

What is the IUPAC name of 4-(5-methyldodecan-5-yl)morpholine?
The IUPAC name of 4-(5-methyldodecan-5-yl)morpholine (CID 138551223) is 4-(5-methyldodecan-5-yl)morpholine.
What is the SMILES notation for 4-(5-methyldodecan-5-yl)morpholine?
The canonical SMILES for 4-(5-methyldodecan-5-yl)morpholine is CCCCCCCC(C)(CCCC)N1CCOCC1.
What is the InChIKey of 4-(5-methyldodecan-5-yl)morpholine?
The InChIKey is SOYYUYFZOJSFTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H35NO/c1-4-6-8-9-10-12-17(3,11-7-5-2)18-13-15-19-16-14-18/h4-16H2,1-3H3.
What are the key properties of 4-(5-methyldodecan-5-yl)morpholine?
4-(5-methyldodecan-5-yl)morpholine has a molecular weight of 269.47 g/mol, XLogP of 4.63, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-methyldodecan-5-yl)morpholine is sourced from PubChem (CID 138551223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).