4-(cyclohex-3-en-1-ylmethyl)morpholine

C11H19NO — CID 2849466

IUPAC4-(cyclohex-3-en-1-ylmethyl)morpholine
SMILESC1=CCC(CN2CCOCC2)CC1
InChIInChI=1S/C11H19NO/c1-2-4-11(5-3-1)10-12-6-8-13-9-7-12/h1-2,11H,3-10H2
InChIKeyKPKYRRUPHUATDQ-UHFFFAOYSA-N
MW181.28 g/mol
LogP1.67
Rot. Bonds2

About 4-(cyclohex-3-en-1-ylmethyl)morpholine

4-(cyclohex-3-en-1-ylmethyl)morpholine (PubChem CID 2849466) has the molecular formula C11H19NO and a molecular weight of 181.28 g/mol. Its IUPAC name is 4-(cyclohex-3-en-1-ylmethyl)morpholine.

Molecular Properties

Compound Name4-(cyclohex-3-en-1-ylmethyl)morpholine
PubChem CID2849466
Molecular FormulaC11H19NO
Molecular Weight181.28 g/mol
Exact Mass181.15
IUPAC Name4-(cyclohex-3-en-1-ylmethyl)morpholine
SMILESC1=CCC(CN2CCOCC2)CC1
InChIInChI=1S/C11H19NO/c1-2-4-11(5-3-1)10-12-6-8-13-9-7-12/h1-2,11H,3-10H2
InChIKeyKPKYRRUPHUATDQ-UHFFFAOYSA-N
XLogP1.67
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.28
LogP ≤ 51.67
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

CID 2845488
CID 2845488
CID 10977479
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CID 306090
CID 306090
CID 258775
CID 258775
CID 2802205
CID 2802205
CID 3152374
CID 3152374
CID 15570195
CID 15570195
CID 2846117
CID 2846117
CID 3152141
CID 3152141
CID 4417841
CID 4417841
CID 74229167
CID 74229167
CID 11356517
CID 11356517

Frequently Asked Questions

What is the IUPAC name of 4-(cyclohex-3-en-1-ylmethyl)morpholine?
The IUPAC name of 4-(cyclohex-3-en-1-ylmethyl)morpholine (CID 2849466) is 4-(cyclohex-3-en-1-ylmethyl)morpholine.
What is the SMILES notation for 4-(cyclohex-3-en-1-ylmethyl)morpholine?
The canonical SMILES for 4-(cyclohex-3-en-1-ylmethyl)morpholine is C1=CCC(CN2CCOCC2)CC1.
What is the InChIKey of 4-(cyclohex-3-en-1-ylmethyl)morpholine?
The InChIKey is KPKYRRUPHUATDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO/c1-2-4-11(5-3-1)10-12-6-8-13-9-7-12/h1-2,11H,3-10H2.
What are the key properties of 4-(cyclohex-3-en-1-ylmethyl)morpholine?
4-(cyclohex-3-en-1-ylmethyl)morpholine has a molecular weight of 181.28 g/mol, XLogP of 1.67, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclohex-3-en-1-ylmethyl)morpholine is sourced from PubChem (CID 2849466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).