4-(4-tert-butylcyclohex-3-en-1-yl)morpholine

C14H25NO — CID 164769209

IUPAC4-(4-tert-butylcyclohex-3-en-1-yl)morpholine
SMILESCC(C)(C)C1=CCC(N2CCOCC2)CC1
InChIInChI=1S/C14H25NO/c1-14(2,3)12-4-6-13(7-5-12)15-8-10-16-11-9-15/h4,13H,5-11H2,1-3H3
InChIKeySFGPNRWQYLCOMB-UHFFFAOYSA-N
MW223.36 g/mol
LogP2.84
Rot. Bonds1

About 4-(4-tert-butylcyclohex-3-en-1-yl)morpholine

4-(4-tert-butylcyclohex-3-en-1-yl)morpholine (PubChem CID 164769209) has the molecular formula C14H25NO and a molecular weight of 223.36 g/mol. Its IUPAC name is 4-(4-tert-butylcyclohex-3-en-1-yl)morpholine.

Molecular Properties

Compound Name4-(4-tert-butylcyclohex-3-en-1-yl)morpholine
PubChem CID164769209
Molecular FormulaC14H25NO
Molecular Weight223.36 g/mol
Exact Mass223.19
IUPAC Name4-(4-tert-butylcyclohex-3-en-1-yl)morpholine
SMILESCC(C)(C)C1=CCC(N2CCOCC2)CC1
InChIInChI=1S/C14H25NO/c1-14(2,3)12-4-6-13(7-5-12)15-8-10-16-11-9-15/h4,13H,5-11H2,1-3H3
InChIKeySFGPNRWQYLCOMB-UHFFFAOYSA-N
XLogP2.84
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.36
LogP ≤ 52.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-(4-tert-butylcyclohex-3-en-1-yl)morpholine?
The IUPAC name of 4-(4-tert-butylcyclohex-3-en-1-yl)morpholine (CID 164769209) is 4-(4-tert-butylcyclohex-3-en-1-yl)morpholine.
What is the SMILES notation for 4-(4-tert-butylcyclohex-3-en-1-yl)morpholine?
The canonical SMILES for 4-(4-tert-butylcyclohex-3-en-1-yl)morpholine is CC(C)(C)C1=CCC(N2CCOCC2)CC1.
What is the InChIKey of 4-(4-tert-butylcyclohex-3-en-1-yl)morpholine?
The InChIKey is SFGPNRWQYLCOMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO/c1-14(2,3)12-4-6-13(7-5-12)15-8-10-16-11-9-15/h4,13H,5-11H2,1-3H3.
What are the key properties of 4-(4-tert-butylcyclohex-3-en-1-yl)morpholine?
4-(4-tert-butylcyclohex-3-en-1-yl)morpholine has a molecular weight of 223.36 g/mol, XLogP of 2.84, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-tert-butylcyclohex-3-en-1-yl)morpholine is sourced from PubChem (CID 164769209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).