4-(3,6-dimethylcyclohexen-1-yl)morpholine

C12H21NO — CID 121011898

IUPAC4-(3,6-dimethylcyclohexen-1-yl)morpholine
SMILESCC1C=C(N2CCOCC2)C(C)CC1
InChIInChI=1S/C12H21NO/c1-10-3-4-11(2)12(9-10)13-5-7-14-8-6-13/h9-11H,3-8H2,1-2H3
InChIKeyMZKSZNZMQBYTII-UHFFFAOYSA-N
MW195.31 g/mol
LogP2.27
Rot. Bonds1

About 4-(3,6-dimethylcyclohexen-1-yl)morpholine

4-(3,6-dimethylcyclohexen-1-yl)morpholine (PubChem CID 121011898) has the molecular formula C12H21NO and a molecular weight of 195.31 g/mol. Its IUPAC name is 4-(3,6-dimethylcyclohexen-1-yl)morpholine.

Molecular Properties

Compound Name4-(3,6-dimethylcyclohexen-1-yl)morpholine
PubChem CID121011898
Molecular FormulaC12H21NO
Molecular Weight195.31 g/mol
Exact Mass195.16
IUPAC Name4-(3,6-dimethylcyclohexen-1-yl)morpholine
SMILESCC1C=C(N2CCOCC2)C(C)CC1
InChIInChI=1S/C12H21NO/c1-10-3-4-11(2)12(9-10)13-5-7-14-8-6-13/h9-11H,3-8H2,1-2H3
InChIKeyMZKSZNZMQBYTII-UHFFFAOYSA-N
XLogP2.27
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.31
LogP ≤ 52.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 4-(3,6-dimethylcyclohexen-1-yl)morpholine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-(3,6-dimethylcyclohexen-1-yl)morpholine?
The IUPAC name of 4-(3,6-dimethylcyclohexen-1-yl)morpholine (CID 121011898) is 4-(3,6-dimethylcyclohexen-1-yl)morpholine.
What is the SMILES notation for 4-(3,6-dimethylcyclohexen-1-yl)morpholine?
The canonical SMILES for 4-(3,6-dimethylcyclohexen-1-yl)morpholine is CC1C=C(N2CCOCC2)C(C)CC1.
What is the InChIKey of 4-(3,6-dimethylcyclohexen-1-yl)morpholine?
The InChIKey is MZKSZNZMQBYTII-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21NO/c1-10-3-4-11(2)12(9-10)13-5-7-14-8-6-13/h9-11H,3-8H2,1-2H3.
What are the key properties of 4-(3,6-dimethylcyclohexen-1-yl)morpholine?
4-(3,6-dimethylcyclohexen-1-yl)morpholine has a molecular weight of 195.31 g/mol, XLogP of 2.27, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,6-dimethylcyclohexen-1-yl)morpholine is sourced from PubChem (CID 121011898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).