6-ethyl-6-methylspiro[morpholine-2,13'-tricyclo[8.2.1.03,8]trideca-3,5,7-triene]

C19H27NO — CID 114497297

IUPAC6-ethyl-6-methylspiro[morpholine-2,13'-tricyclo[8.2.1.03,8]trideca-3,5,7-triene]
SMILESCCC1(C)CNCC2(O1)C1CCC2Cc2ccccc2C1
InChIInChI=1S/C19H27NO/c1-3-18(2)12-20-13-19(21-18)16-8-9-17(19)11-15-7-5-4-6-14(15)10-16/h4-7,16-17,20H,3,8-13H2,1-2H3
InChIKeyNNHRZRVXSADOSD-UHFFFAOYSA-N
MW285.43 g/mol
LogP3.34
Rot. Bonds1

About 6-ethyl-6-methylspiro[morpholine-2,13'-tricyclo[8.2.1.03,8]trideca-3,5,7-triene]

6-ethyl-6-methylspiro[morpholine-2,13'-tricyclo[8.2.1.03,8]trideca-3,5,7-triene] (PubChem CID 114497297) has the molecular formula C19H27NO and a molecular weight of 285.43 g/mol. Its IUPAC name is 6-ethyl-6-methylspiro[morpholine-2,13'-tricyclo[8.2.1.03,8]trideca-3,5,7-triene].

Molecular Properties

Compound Name6-ethyl-6-methylspiro[morpholine-2,13'-tricyclo[8.2.1.03,8]trideca-3,5,7-triene]
PubChem CID114497297
Molecular FormulaC19H27NO
Molecular Weight285.43 g/mol
Exact Mass285.21
IUPAC Name6-ethyl-6-methylspiro[morpholine-2,13'-tricyclo[8.2.1.03,8]trideca-3,5,7-triene]
SMILESCCC1(C)CNCC2(O1)C1CCC2Cc2ccccc2C1
InChIInChI=1S/C19H27NO/c1-3-18(2)12-20-13-19(21-18)16-8-9-17(19)11-15-7-5-4-6-14(15)10-16/h4-7,16-17,20H,3,8-13H2,1-2H3
InChIKeyNNHRZRVXSADOSD-UHFFFAOYSA-N
XLogP3.34
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.43
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 6-ethyl-6-methylspiro[morpholine-2,13'-tricyclo[8.2.1.03,8]trideca-3,5,7-triene] with MolForge

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Related Compounds

2,2,6-triethyl-6-methylmorpholine
CID 114494557
2',2'-diethylspiro[2,4-dihydro-1H-naphthalene-3,6'-morpholine]
CID 114497122
2-ethyl-2-methyl-1,9-dioxa-4-azaspiro[5.5]undecane
CID 114497305
(15R)-pentacyclo[13.7.0.01,9.02,7.017,22]docosa-2,4,6,17,19,21-hexaene
CID 171404171
2-ethyl-2,8,11-trimethyl-1-oxa-4-azaspiro[5.5]undecane
CID 114497312
2-benzyl-2,6,6-trimethylmorpholine
CID 65126692
(3aS,8bR)-8b-methyl-3a,4-dihydro-3H-indeno[1,2-b]furan-2-one
CID 11240906
2-cyclopropyl-6,6-diethyl-2-methylmorpholine
CID 114497168
2-methoxy-2-(1,2,3,4-tetrahydronaphthalen-2-yl)oxirane
CID 142155631
(1R,7S,16R,22S)-31,32-dimethylheptacyclo[20.8.1.17,16.03,20.05,18.09,14.024,29]dotriaconta-3,5(18),9,11,13,19,24,26,28-nonaene-31,32-diol
CID 15831265
pentacyclo[11.7.0.01,9.02,7.015,20]icosa-2,4,6,15,17,19-hexaene
CID 102574244
6'-ethylspiro[1,2-dihydroindene-3,2'-morpholine]
CID 65122572

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-6-methylspiro[morpholine-2,13'-tricyclo[8.2.1.03,8]trideca-3,5,7-triene]?
The IUPAC name of 6-ethyl-6-methylspiro[morpholine-2,13'-tricyclo[8.2.1.03,8]trideca-3,5,7-triene] (CID 114497297) is 6-ethyl-6-methylspiro[morpholine-2,13'-tricyclo[8.2.1.03,8]trideca-3,5,7-triene].
What is the SMILES notation for 6-ethyl-6-methylspiro[morpholine-2,13'-tricyclo[8.2.1.03,8]trideca-3,5,7-triene]?
The canonical SMILES for 6-ethyl-6-methylspiro[morpholine-2,13'-tricyclo[8.2.1.03,8]trideca-3,5,7-triene] is CCC1(C)CNCC2(O1)C1CCC2Cc2ccccc2C1.
What is the InChIKey of 6-ethyl-6-methylspiro[morpholine-2,13'-tricyclo[8.2.1.03,8]trideca-3,5,7-triene]?
The InChIKey is NNHRZRVXSADOSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27NO/c1-3-18(2)12-20-13-19(21-18)16-8-9-17(19)11-15-7-5-4-6-14(15)10-16/h4-7,16-17,20H,3,8-13H2,1-2H3.
What are the key properties of 6-ethyl-6-methylspiro[morpholine-2,13'-tricyclo[8.2.1.03,8]trideca-3,5,7-triene]?
6-ethyl-6-methylspiro[morpholine-2,13'-tricyclo[8.2.1.03,8]trideca-3,5,7-triene] has a molecular weight of 285.43 g/mol, XLogP of 3.34, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-6-methylspiro[morpholine-2,13'-tricyclo[8.2.1.03,8]trideca-3,5,7-triene] is sourced from PubChem (CID 114497297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).