(3E)-2-ethylidene-3-(3-methoxy-6-methylidenecyclohexa-2,4-dien-1-ylidene)-4-methylmorpholine

C15H19NO2 — CID 143875694

IUPAC(3E)-2-ethylidene-3-(3-methoxy-6-methylidenecyclohexa-2,4-dien-1-ylidene)-4-methylmorpholine
SMILESC=c1ccc(OC)c/c1=C1/C(=CC)OCCN1C
InChIInChI=1S/C15H19NO2/c1-5-14-15(16(3)8-9-18-14)13-10-12(17-4)7-6-11(13)2/h5-7,10H,2,8-9H2,1,3-4H3/b14-5?,15-13+
InChIKeyYIYORZRCCDBQMO-PHSQPBKVSA-N
MW245.32 g/mol
LogP1.08
Rot. Bonds1

About (3E)-2-ethylidene-3-(3-methoxy-6-methylidenecyclohexa-2,4-dien-1-ylidene)-4-methylmorpholine

(3E)-2-ethylidene-3-(3-methoxy-6-methylidenecyclohexa-2,4-dien-1-ylidene)-4-methylmorpholine (PubChem CID 143875694) has the molecular formula C15H19NO2 and a molecular weight of 245.32 g/mol. Its IUPAC name is (3E)-2-ethylidene-3-(3-methoxy-6-methylidenecyclohexa-2,4-dien-1-ylidene)-4-methylmorpholine.

Molecular Properties

Compound Name(3E)-2-ethylidene-3-(3-methoxy-6-methylidenecyclohexa-2,4-dien-1-ylidene)-4-methylmorpholine
PubChem CID143875694
Molecular FormulaC15H19NO2
Molecular Weight245.32 g/mol
Exact Mass245.14
IUPAC Name(3E)-2-ethylidene-3-(3-methoxy-6-methylidenecyclohexa-2,4-dien-1-ylidene)-4-methylmorpholine
SMILESC=c1ccc(OC)c/c1=C1/C(=CC)OCCN1C
InChIInChI=1S/C15H19NO2/c1-5-14-15(16(3)8-9-18-14)13-10-12(17-4)7-6-11(13)2/h5-7,10H,2,8-9H2,1,3-4H3/b14-5?,15-13+
InChIKeyYIYORZRCCDBQMO-PHSQPBKVSA-N
XLogP1.08
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.32
LogP ≤ 51.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze (3E)-2-ethylidene-3-(3-methoxy-6-methylidenecyclohexa-2,4-dien-1-ylidene)-4-methylmorpholine with MolForge

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Related Compounds

4-(5-Methoxycyclohexa-1,5-dien-1-yl)morpholine
CID 12664081
4,4,5,7-tetramethyl-3,6-dihydro-2H-cyclopenta[b][1,4]oxazin-4-ium
CID 58759438
4,7-Dimethyl-2,3,6,7-tetrahydro-1,4-benzoxazine
CID 68074988
7-Methoxy-4-prop-2-enyl-2,3,4a,5-tetrahydro-1,4-benzoxazine
CID 70458047
4-[(4-Methyl-6-propan-2-yloxycyclohexa-1,5-dien-1-yl)methyl]morpholine
CID 71036342
4-[3-(2-Methoxyethoxy)-5-methylcyclohexa-1,3-dien-1-yl]morpholine
CID 71067394
4-[2-(4-Iodo-4-methylcyclohexa-1,5-dien-1-yl)oxyethyl]morpholine
CID 71170410
14-Methoxy-6-oxa-3-azatricyclo[9.4.0.02,7]pentadeca-1,7,9,10,12,14-hexaene
CID 89139683
4-[Iodo-(6-methoxycyclohexa-1,5-dien-1-yl)methyl]-2,6-dimethylmorpholine
CID 89688693
4-[2-[1-(2-Methoxycyclohexa-1,5-dien-1-yl)ethoxy]ethyl]morpholine
CID 89688793
4-[3-(6-Methoxy-3,4-dimethylidenecyclohexa-1,5-dien-1-yl)oxypropyl]morpholine
CID 123336666
4-(5-Methoxyhexa-3,5-dien-3-yl)morpholine
CID 123740206

Frequently Asked Questions

What is the IUPAC name of (3E)-2-ethylidene-3-(3-methoxy-6-methylidenecyclohexa-2,4-dien-1-ylidene)-4-methylmorpholine?
The IUPAC name of (3E)-2-ethylidene-3-(3-methoxy-6-methylidenecyclohexa-2,4-dien-1-ylidene)-4-methylmorpholine (CID 143875694) is (3E)-2-ethylidene-3-(3-methoxy-6-methylidenecyclohexa-2,4-dien-1-ylidene)-4-methylmorpholine.
What is the SMILES notation for (3E)-2-ethylidene-3-(3-methoxy-6-methylidenecyclohexa-2,4-dien-1-ylidene)-4-methylmorpholine?
The canonical SMILES for (3E)-2-ethylidene-3-(3-methoxy-6-methylidenecyclohexa-2,4-dien-1-ylidene)-4-methylmorpholine is C=c1ccc(OC)c/c1=C1/C(=CC)OCCN1C.
What is the InChIKey of (3E)-2-ethylidene-3-(3-methoxy-6-methylidenecyclohexa-2,4-dien-1-ylidene)-4-methylmorpholine?
The InChIKey is YIYORZRCCDBQMO-PHSQPBKVSA-N. The full InChI is InChI=1S/C15H19NO2/c1-5-14-15(16(3)8-9-18-14)13-10-12(17-4)7-6-11(13)2/h5-7,10H,2,8-9H2,1,3-4H3/b14-5?,15-13+.
What are the key properties of (3E)-2-ethylidene-3-(3-methoxy-6-methylidenecyclohexa-2,4-dien-1-ylidene)-4-methylmorpholine?
(3E)-2-ethylidene-3-(3-methoxy-6-methylidenecyclohexa-2,4-dien-1-ylidene)-4-methylmorpholine has a molecular weight of 245.32 g/mol, XLogP of 1.08, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3E)-2-ethylidene-3-(3-methoxy-6-methylidenecyclohexa-2,4-dien-1-ylidene)-4-methylmorpholine is sourced from PubChem (CID 143875694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).