4-(2-methyldodecyl)morpholine

C17H35NO — CID 11076481

IUPAC4-(2-methyldodecyl)morpholine
SMILESCCCCCCCCCCC(C)CN1CCOCC1
InChIInChI=1S/C17H35NO/c1-3-4-5-6-7-8-9-10-11-17(2)16-18-12-14-19-15-13-18/h17H,3-16H2,1-2H3
InChIKeyYFJDWJGCPAVHGC-UHFFFAOYSA-N
MW269.47 g/mol
LogP4.49
Rot. Bonds11

About 4-(2-methyldodecyl)morpholine

4-(2-methyldodecyl)morpholine (PubChem CID 11076481) has the molecular formula C17H35NO and a molecular weight of 269.47 g/mol. Its IUPAC name is 4-(2-methyldodecyl)morpholine.

Molecular Properties

Compound Name4-(2-methyldodecyl)morpholine
PubChem CID11076481
Molecular FormulaC17H35NO
Molecular Weight269.47 g/mol
Exact Mass269.27
IUPAC Name4-(2-methyldodecyl)morpholine
SMILESCCCCCCCCCCC(C)CN1CCOCC1
InChIInChI=1S/C17H35NO/c1-3-4-5-6-7-8-9-10-11-17(2)16-18-12-14-19-15-13-18/h17H,3-16H2,1-2H3
InChIKeyYFJDWJGCPAVHGC-UHFFFAOYSA-N
XLogP4.49
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.47
LogP ≤ 54.49
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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Frequently Asked Questions

What is the IUPAC name of 4-(2-methyldodecyl)morpholine?
The IUPAC name of 4-(2-methyldodecyl)morpholine (CID 11076481) is 4-(2-methyldodecyl)morpholine.
What is the SMILES notation for 4-(2-methyldodecyl)morpholine?
The canonical SMILES for 4-(2-methyldodecyl)morpholine is CCCCCCCCCCC(C)CN1CCOCC1.
What is the InChIKey of 4-(2-methyldodecyl)morpholine?
The InChIKey is YFJDWJGCPAVHGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H35NO/c1-3-4-5-6-7-8-9-10-11-17(2)16-18-12-14-19-15-13-18/h17H,3-16H2,1-2H3.
What are the key properties of 4-(2-methyldodecyl)morpholine?
4-(2-methyldodecyl)morpholine has a molecular weight of 269.47 g/mol, XLogP of 4.49, 11 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methyldodecyl)morpholine is sourced from PubChem (CID 11076481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).