4-(2-chloroprop-2-enyl)-2,2,6-trimethylmorpholine

C10H18ClNO — CID 48637481

IUPAC4-(2-chloroprop-2-enyl)-2,2,6-trimethylmorpholine
SMILESC=C(Cl)CN1CC(C)OC(C)(C)C1
InChIInChI=1S/C10H18ClNO/c1-8(11)5-12-6-9(2)13-10(3,4)7-12/h9H,1,5-7H2,2-4H3
InChIKeyMEUJWZMOWIJVAL-UHFFFAOYSA-N
MW203.71 g/mol
LogP2.24
Rot. Bonds2

About 4-(2-chloroprop-2-enyl)-2,2,6-trimethylmorpholine

4-(2-chloroprop-2-enyl)-2,2,6-trimethylmorpholine (PubChem CID 48637481) has the molecular formula C10H18ClNO and a molecular weight of 203.71 g/mol. Its IUPAC name is 4-(2-chloroprop-2-enyl)-2,2,6-trimethylmorpholine.

Molecular Properties

Compound Name4-(2-chloroprop-2-enyl)-2,2,6-trimethylmorpholine
PubChem CID48637481
Molecular FormulaC10H18ClNO
Molecular Weight203.71 g/mol
Exact Mass203.11
IUPAC Name4-(2-chloroprop-2-enyl)-2,2,6-trimethylmorpholine
SMILESC=C(Cl)CN1CC(C)OC(C)(C)C1
InChIInChI=1S/C10H18ClNO/c1-8(11)5-12-6-9(2)13-10(3,4)7-12/h9H,1,5-7H2,2-4H3
InChIKeyMEUJWZMOWIJVAL-UHFFFAOYSA-N
XLogP2.24
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.71
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(2-chloroprop-2-enyl)-2,2,6-trimethylmorpholine?
The IUPAC name of 4-(2-chloroprop-2-enyl)-2,2,6-trimethylmorpholine (CID 48637481) is 4-(2-chloroprop-2-enyl)-2,2,6-trimethylmorpholine.
What is the SMILES notation for 4-(2-chloroprop-2-enyl)-2,2,6-trimethylmorpholine?
The canonical SMILES for 4-(2-chloroprop-2-enyl)-2,2,6-trimethylmorpholine is C=C(Cl)CN1CC(C)OC(C)(C)C1.
What is the InChIKey of 4-(2-chloroprop-2-enyl)-2,2,6-trimethylmorpholine?
The InChIKey is MEUJWZMOWIJVAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18ClNO/c1-8(11)5-12-6-9(2)13-10(3,4)7-12/h9H,1,5-7H2,2-4H3.
What are the key properties of 4-(2-chloroprop-2-enyl)-2,2,6-trimethylmorpholine?
4-(2-chloroprop-2-enyl)-2,2,6-trimethylmorpholine has a molecular weight of 203.71 g/mol, XLogP of 2.24, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-chloroprop-2-enyl)-2,2,6-trimethylmorpholine is sourced from PubChem (CID 48637481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).