2,3-dimethyl-4-(2-methylidenebutyl)morpholine

C11H21NO — CID 131132113

IUPAC2,3-dimethyl-4-(2-methylidenebutyl)morpholine
SMILESC=C(CC)CN1CCOC(C)C1C
InChIInChI=1S/C11H21NO/c1-5-9(2)8-12-6-7-13-11(4)10(12)3/h10-11H,2,5-8H2,1,3-4H3
InChIKeyIADLTVLQIHSSBZ-UHFFFAOYSA-N
MW183.29 g/mol
LogP2.06
Rot. Bonds3

About 2,3-dimethyl-4-(2-methylidenebutyl)morpholine

2,3-dimethyl-4-(2-methylidenebutyl)morpholine (PubChem CID 131132113) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is 2,3-dimethyl-4-(2-methylidenebutyl)morpholine.

Molecular Properties

Compound Name2,3-dimethyl-4-(2-methylidenebutyl)morpholine
PubChem CID131132113
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name2,3-dimethyl-4-(2-methylidenebutyl)morpholine
SMILESC=C(CC)CN1CCOC(C)C1C
InChIInChI=1S/C11H21NO/c1-5-9(2)8-12-6-7-13-11(4)10(12)3/h10-11H,2,5-8H2,1,3-4H3
InChIKeyIADLTVLQIHSSBZ-UHFFFAOYSA-N
XLogP2.06
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 52.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2,3-Dimethyl-2-morpholinobutene
CID 145488126
2,6-Dimethyl-4-(1,2,2-trifluoro-3-methylbut-3-enyl)morpholine
CID 134531057
4-(1,2-Difluoro-2,3-dimethylbut-3-enyl)-2,6-dimethylmorpholine
CID 134531059
4-(3-Methyl-2-methylidenebut-3-en-1-yl)morpholine
CID 12933365
Morpholine, 4-(1,2-dimethyl-2-propenyl)-
CID 12616305
4-(3-Methylbut-3-enyl)morpholine
CID 13609252
2,3,4,5-Tetramethyl-6-methylidenemorpholine
CID 22087090
3,3,4,5-Tetramethyl-2-methylidenemorpholine
CID 22154609
4-Methyl-4-(2-methylprop-2-enyl)morpholin-4-ium
CID 23062109
3,3,4,6-Tetramethyl-2-methylidenemorpholine
CID 53819024
4-(2-Methylidenebutyl)morpholine
CID 68081450
4-(2,3-Dimethylbut-3-enyl)morpholine
CID 123569288

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-4-(2-methylidenebutyl)morpholine?
The IUPAC name of 2,3-dimethyl-4-(2-methylidenebutyl)morpholine (CID 131132113) is 2,3-dimethyl-4-(2-methylidenebutyl)morpholine.
What is the SMILES notation for 2,3-dimethyl-4-(2-methylidenebutyl)morpholine?
The canonical SMILES for 2,3-dimethyl-4-(2-methylidenebutyl)morpholine is C=C(CC)CN1CCOC(C)C1C.
What is the InChIKey of 2,3-dimethyl-4-(2-methylidenebutyl)morpholine?
The InChIKey is IADLTVLQIHSSBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-5-9(2)8-12-6-7-13-11(4)10(12)3/h10-11H,2,5-8H2,1,3-4H3.
What are the key properties of 2,3-dimethyl-4-(2-methylidenebutyl)morpholine?
2,3-dimethyl-4-(2-methylidenebutyl)morpholine has a molecular weight of 183.29 g/mol, XLogP of 2.06, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-4-(2-methylidenebutyl)morpholine is sourced from PubChem (CID 131132113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).