(2E,4E,6E)-6-[3-(cyclohexen-1-yl)cyclohex-2-en-1-ylidene]-3-methylhexa-2,4-dien-1-amine

C19H27N — CID 121373967

IUPAC(2E,4E,6E)-6-[3-(cyclohexen-1-yl)cyclohex-2-en-1-ylidene]-3-methylhexa-2,4-dien-1-amine
SMILESCC(/C=C/C=C1/C=C(C2=CCCCC2)CCC1)=C\CN
InChIInChI=1S/C19H27N/c1-16(13-14-20)7-5-8-17-9-6-12-19(15-17)18-10-3-2-4-11-18/h5,7-8,10,13,15H,2-4,6,9,11-12,14,20H2,1H3/b7-5+,16-13+,17-8+
InChIKeyPLXPTUWLJNJXOJ-OTLMWCFISA-N
MW269.43 g/mol
LogP4.98
Rot. Bonds4

About (2E,4E,6E)-6-[3-(cyclohexen-1-yl)cyclohex-2-en-1-ylidene]-3-methylhexa-2,4-dien-1-amine

(2E,4E,6E)-6-[3-(cyclohexen-1-yl)cyclohex-2-en-1-ylidene]-3-methylhexa-2,4-dien-1-amine (PubChem CID 121373967) has the molecular formula C19H27N and a molecular weight of 269.43 g/mol. Its IUPAC name is (2E,4E,6E)-6-[3-(cyclohexen-1-yl)cyclohex-2-en-1-ylidene]-3-methylhexa-2,4-dien-1-amine.

Molecular Properties

Compound Name(2E,4E,6E)-6-[3-(cyclohexen-1-yl)cyclohex-2-en-1-ylidene]-3-methylhexa-2,4-dien-1-amine
PubChem CID121373967
Molecular FormulaC19H27N
Molecular Weight269.43 g/mol
Exact Mass269.21
IUPAC Name(2E,4E,6E)-6-[3-(cyclohexen-1-yl)cyclohex-2-en-1-ylidene]-3-methylhexa-2,4-dien-1-amine
SMILESCC(/C=C/C=C1/C=C(C2=CCCCC2)CCC1)=C\CN
InChIInChI=1S/C19H27N/c1-16(13-14-20)7-5-8-17-9-6-12-19(15-17)18-10-3-2-4-11-18/h5,7-8,10,13,15H,2-4,6,9,11-12,14,20H2,1H3/b7-5+,16-13+,17-8+
InChIKeyPLXPTUWLJNJXOJ-OTLMWCFISA-N
XLogP4.98
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.43
LogP ≤ 54.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(2E,4E,6Z,8E)-9-(cyclohexen-1-yl)-7-(4-methoxyphenyl)-3-methylnona-2,4,6,8-tetraen-1-amine
CID 121373917
(1E)-1-[(1E)-cyclopentadecen-1-yl]cyclopentadecene
CID 139760940
1-(cyclodecen-1-yl)cyclodecene
CID 54296371
1-(cyclopenten-1-yl)cyclooctene
CID 91463872
ethyl (2E)-2-[3,5-di(cyclohexen-1-yl)cyclohepta-2,4-dien-1-ylidene]acetate
CID 42639984
3-(cyclohexen-1-yl)cyclohex-2-en-1-imine
CID 175712775
(2Z,4E,6E,8E)-9-(2,6-dimethylcyclohexen-1-yl)-3,7-dimethylnona-2,4,6,8-tetraen-1-amine
CID 143520371
2-[2-(cyclohexen-1-yl)phenyl]ethanamine
CID 115022405
CID 67945351
CID 67945351
1-(cyclohepten-1-yl)cycloheptene;trichloro(ethyl)silane
CID 67277470
ethane;1-(4-methylpent-3-enyl)cyclohexene
CID 142984227
chloro-ethyl-dimethylsilane;1-(cyclohepten-1-yl)cycloheptene
CID 66646162

Frequently Asked Questions

What is the IUPAC name of (2E,4E,6E)-6-[3-(cyclohexen-1-yl)cyclohex-2-en-1-ylidene]-3-methylhexa-2,4-dien-1-amine?
The IUPAC name of (2E,4E,6E)-6-[3-(cyclohexen-1-yl)cyclohex-2-en-1-ylidene]-3-methylhexa-2,4-dien-1-amine (CID 121373967) is (2E,4E,6E)-6-[3-(cyclohexen-1-yl)cyclohex-2-en-1-ylidene]-3-methylhexa-2,4-dien-1-amine.
What is the SMILES notation for (2E,4E,6E)-6-[3-(cyclohexen-1-yl)cyclohex-2-en-1-ylidene]-3-methylhexa-2,4-dien-1-amine?
The canonical SMILES for (2E,4E,6E)-6-[3-(cyclohexen-1-yl)cyclohex-2-en-1-ylidene]-3-methylhexa-2,4-dien-1-amine is CC(/C=C/C=C1/C=C(C2=CCCCC2)CCC1)=C\CN.
What is the InChIKey of (2E,4E,6E)-6-[3-(cyclohexen-1-yl)cyclohex-2-en-1-ylidene]-3-methylhexa-2,4-dien-1-amine?
The InChIKey is PLXPTUWLJNJXOJ-OTLMWCFISA-N. The full InChI is InChI=1S/C19H27N/c1-16(13-14-20)7-5-8-17-9-6-12-19(15-17)18-10-3-2-4-11-18/h5,7-8,10,13,15H,2-4,6,9,11-12,14,20H2,1H3/b7-5+,16-13+,17-8+.
What are the key properties of (2E,4E,6E)-6-[3-(cyclohexen-1-yl)cyclohex-2-en-1-ylidene]-3-methylhexa-2,4-dien-1-amine?
(2E,4E,6E)-6-[3-(cyclohexen-1-yl)cyclohex-2-en-1-ylidene]-3-methylhexa-2,4-dien-1-amine has a molecular weight of 269.43 g/mol, XLogP of 4.98, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2E,4E,6E)-6-[3-(cyclohexen-1-yl)cyclohex-2-en-1-ylidene]-3-methylhexa-2,4-dien-1-amine is sourced from PubChem (CID 121373967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).