4-methyl-2-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenylmethyl)morpholine

C21H25NO — CID 12832483

IUPAC4-methyl-2-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenylmethyl)morpholine
SMILESCN1CCOC(CC2c3ccccc3CCc3ccccc32)C1
InChIInChI=1S/C21H25NO/c1-22-12-13-23-18(15-22)14-21-19-8-4-2-6-16(19)10-11-17-7-3-5-9-20(17)21/h2-9,18,21H,10-15H2,1H3
InChIKeyBYSYBPCTJQOKPC-UHFFFAOYSA-N
MW307.44 g/mol
LogP3.64
Rot. Bonds2

About 4-methyl-2-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenylmethyl)morpholine

4-methyl-2-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenylmethyl)morpholine (PubChem CID 12832483) has the molecular formula C21H25NO and a molecular weight of 307.44 g/mol. Its IUPAC name is 4-methyl-2-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenylmethyl)morpholine.

Molecular Properties

Compound Name4-methyl-2-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenylmethyl)morpholine
PubChem CID12832483
Molecular FormulaC21H25NO
Molecular Weight307.44 g/mol
Exact Mass307.19
IUPAC Name4-methyl-2-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenylmethyl)morpholine
SMILESCN1CCOC(CC2c3ccccc3CCc3ccccc32)C1
InChIInChI=1S/C21H25NO/c1-22-12-13-23-18(15-22)14-21-19-8-4-2-6-16(19)10-11-17-7-3-5-9-20(17)21/h2-9,18,21H,10-15H2,1H3
InChIKeyBYSYBPCTJQOKPC-UHFFFAOYSA-N
XLogP3.64
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.44
LogP ≤ 53.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-(2,2-Diphenylethyl)morpholine
CID 240345
Hepzidine
CID 70593
4-Benzyl-1-[3-phenylpropoxy)propyl]piperidine
CID 44563685
4-Benzyl-2-(2-phenylethyl)morpholine
CID 20354789
4-(2-{3-[1-Phenyl-meth-(E)-ylidene]-3H-inden-1-yl}-ethyl)-morpholine
CID 44350470
4-[2-[(3E)-3-[(2-methylphenyl)methylidene]inden-1-yl]ethyl]morpholine
CID 118332422
4-(10,11-dihydro-5H-dibenzo[a,d]cyclohepten-5-yloxy)-1-propylpiperidine
CID 203907
4-[[(2S,6R)-3-oxatetracyclo[12.4.0.02,6.07,12]octadeca-1(18),7,9,11,14,16-hexaen-4-yl]methyl]morpholine
CID 44326390
1-{2-[(2-Methylphenyl)(phenyl)methoxy]ethyl}piperidine
CID 56680450
trans-(1S,2S)-N-methyl-2-(3-phenylpropoxy)-N-(3-phenylpropyl)cyclohexan-1-amine
CID 71769269
4-[(2-Methylphenyl)methyl]-2-(2-phenylethyl)morpholine
CID 72737772
5H-Dibenzo(a,d)cycloheptene, 10,11-dihydro-5-(3-morpholinopropylidene)-
CID 21792

Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenylmethyl)morpholine?
The IUPAC name of 4-methyl-2-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenylmethyl)morpholine (CID 12832483) is 4-methyl-2-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenylmethyl)morpholine.
What is the SMILES notation for 4-methyl-2-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenylmethyl)morpholine?
The canonical SMILES for 4-methyl-2-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenylmethyl)morpholine is CN1CCOC(CC2c3ccccc3CCc3ccccc32)C1.
What is the InChIKey of 4-methyl-2-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenylmethyl)morpholine?
The InChIKey is BYSYBPCTJQOKPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25NO/c1-22-12-13-23-18(15-22)14-21-19-8-4-2-6-16(19)10-11-17-7-3-5-9-20(17)21/h2-9,18,21H,10-15H2,1H3.
What are the key properties of 4-methyl-2-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenylmethyl)morpholine?
4-methyl-2-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenylmethyl)morpholine has a molecular weight of 307.44 g/mol, XLogP of 3.64, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenylmethyl)morpholine is sourced from PubChem (CID 12832483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).