(1Z,5Z,7E)-1-(cyclohexen-1-yl)-N-[(E)-dec-4-en-3-yl]-7-(4-ethenylcyclohex-2-en-1-yl)-4-methylidenenona-1,5,7-trien-1-amine

C34H51N — CID 88987024

IUPAC(1Z,5Z,7E)-1-(cyclohexen-1-yl)-N-[(E)-dec-4-en-3-yl]-7-(4-ethenylcyclohex-2-en-1-yl)-4-methylidenenona-1,5,7-trien-1-amine
SMILESC=CC1C=CC(C(/C=C\C(=C)C/C=C(\NC(/C=C/CCCCC)CC)C2=CCCCC2)=C/C)CC1
InChIInChI=1S/C34H51N/c1-6-10-11-12-16-19-33(9-4)35-34(32-17-14-13-15-18-32)27-21-28(5)20-24-30(8-3)31-25-22-29(7-2)23-26-31/h7-8,16-17,19-20,22,24-25,27,29,31,33,35H,2,5-6,9-15,18,21,23,26H2,1,3-4H3/b19-16+,24-20-,30-8+,34-27-
InChIKeyWYNCIIHDJWUONG-WVKXKCSLSA-N
MW473.79 g/mol
LogP10.09
Rot. Bonds15

About (1Z,5Z,7E)-1-(cyclohexen-1-yl)-N-[(E)-dec-4-en-3-yl]-7-(4-ethenylcyclohex-2-en-1-yl)-4-methylidenenona-1,5,7-trien-1-amine

(1Z,5Z,7E)-1-(cyclohexen-1-yl)-N-[(E)-dec-4-en-3-yl]-7-(4-ethenylcyclohex-2-en-1-yl)-4-methylidenenona-1,5,7-trien-1-amine (PubChem CID 88987024) has the molecular formula C34H51N and a molecular weight of 473.79 g/mol. Its IUPAC name is (1Z,5Z,7E)-1-(cyclohexen-1-yl)-N-[(E)-dec-4-en-3-yl]-7-(4-ethenylcyclohex-2-en-1-yl)-4-methylidenenona-1,5,7-trien-1-amine.

Molecular Properties

Compound Name(1Z,5Z,7E)-1-(cyclohexen-1-yl)-N-[(E)-dec-4-en-3-yl]-7-(4-ethenylcyclohex-2-en-1-yl)-4-methylidenenona-1,5,7-trien-1-amine
PubChem CID88987024
Molecular FormulaC34H51N
Molecular Weight473.79 g/mol
Exact Mass473.40
IUPAC Name(1Z,5Z,7E)-1-(cyclohexen-1-yl)-N-[(E)-dec-4-en-3-yl]-7-(4-ethenylcyclohex-2-en-1-yl)-4-methylidenenona-1,5,7-trien-1-amine
SMILESC=CC1C=CC(C(/C=C\C(=C)C/C=C(\NC(/C=C/CCCCC)CC)C2=CCCCC2)=C/C)CC1
InChIInChI=1S/C34H51N/c1-6-10-11-12-16-19-33(9-4)35-34(32-17-14-13-15-18-32)27-21-28(5)20-24-30(8-3)31-25-22-29(7-2)23-26-31/h7-8,16-17,19-20,22,24-25,27,29,31,33,35H,2,5-6,9-15,18,21,23,26H2,1,3-4H3/b19-16+,24-20-,30-8+,34-27-
InChIKeyWYNCIIHDJWUONG-WVKXKCSLSA-N
XLogP10.09
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds15
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500473.79
LogP ≤ 510.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze (1Z,5Z,7E)-1-(cyclohexen-1-yl)-N-[(E)-dec-4-en-3-yl]-7-(4-ethenylcyclohex-2-en-1-yl)-4-methylidenenona-1,5,7-trien-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (1Z,5Z,7E)-1-(cyclohexen-1-yl)-N-[(E)-dec-4-en-3-yl]-7-(4-ethenylcyclohex-2-en-1-yl)-4-methylidenenona-1,5,7-trien-1-amine?
The IUPAC name of (1Z,5Z,7E)-1-(cyclohexen-1-yl)-N-[(E)-dec-4-en-3-yl]-7-(4-ethenylcyclohex-2-en-1-yl)-4-methylidenenona-1,5,7-trien-1-amine (CID 88987024) is (1Z,5Z,7E)-1-(cyclohexen-1-yl)-N-[(E)-dec-4-en-3-yl]-7-(4-ethenylcyclohex-2-en-1-yl)-4-methylidenenona-1,5,7-trien-1-amine.
What is the SMILES notation for (1Z,5Z,7E)-1-(cyclohexen-1-yl)-N-[(E)-dec-4-en-3-yl]-7-(4-ethenylcyclohex-2-en-1-yl)-4-methylidenenona-1,5,7-trien-1-amine?
The canonical SMILES for (1Z,5Z,7E)-1-(cyclohexen-1-yl)-N-[(E)-dec-4-en-3-yl]-7-(4-ethenylcyclohex-2-en-1-yl)-4-methylidenenona-1,5,7-trien-1-amine is C=CC1C=CC(C(/C=C\C(=C)C/C=C(\NC(/C=C/CCCCC)CC)C2=CCCCC2)=C/C)CC1.
What is the InChIKey of (1Z,5Z,7E)-1-(cyclohexen-1-yl)-N-[(E)-dec-4-en-3-yl]-7-(4-ethenylcyclohex-2-en-1-yl)-4-methylidenenona-1,5,7-trien-1-amine?
The InChIKey is WYNCIIHDJWUONG-WVKXKCSLSA-N. The full InChI is InChI=1S/C34H51N/c1-6-10-11-12-16-19-33(9-4)35-34(32-17-14-13-15-18-32)27-21-28(5)20-24-30(8-3)31-25-22-29(7-2)23-26-31/h7-8,16-17,19-20,22,24-25,27,29,31,33,35H,2,5-6,9-15,18,21,23,26H2,1,3-4H3/b19-16+,24-20-,30-8+,34-27-.
What are the key properties of (1Z,5Z,7E)-1-(cyclohexen-1-yl)-N-[(E)-dec-4-en-3-yl]-7-(4-ethenylcyclohex-2-en-1-yl)-4-methylidenenona-1,5,7-trien-1-amine?
(1Z,5Z,7E)-1-(cyclohexen-1-yl)-N-[(E)-dec-4-en-3-yl]-7-(4-ethenylcyclohex-2-en-1-yl)-4-methylidenenona-1,5,7-trien-1-amine has a molecular weight of 473.79 g/mol, XLogP of 10.09, 15 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1Z,5Z,7E)-1-(cyclohexen-1-yl)-N-[(E)-dec-4-en-3-yl]-7-(4-ethenylcyclohex-2-en-1-yl)-4-methylidenenona-1,5,7-trien-1-amine is sourced from PubChem (CID 88987024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).