1-[2-[(3E,6E,8Z)-4,6-dimethyldeca-1,3,6,8-tetraen-3-yl]cyclopenta-2,4-dien-1-yl]-1-[(Z)-prop-1-enyl]hydrazine

C20H28N2 — CID 166865898

IUPAC1-[2-[(3E,6E,8Z)-4,6-dimethyldeca-1,3,6,8-tetraen-3-yl]cyclopenta-2,4-dien-1-yl]-1-[(Z)-prop-1-enyl]hydrazine
SMILESC=C/C(C1=CC=CC1N(N)/C=C\C)=C(/C)C/C(C)=C/C=C\C
InChIInChI=1S/C20H28N2/c1-6-9-11-16(4)15-17(5)18(8-3)19-12-10-13-20(19)22(21)14-7-2/h6-14,20H,3,15,21H2,1-2,4-5H3/b9-6-,14-7-,16-11+,18-17+
InChIKeyQBFKRSYUCVIRMY-SAWOLABLSA-N
MW296.46 g/mol
LogP4.98
Rot. Bonds7

About 1-[2-[(3E,6E,8Z)-4,6-dimethyldeca-1,3,6,8-tetraen-3-yl]cyclopenta-2,4-dien-1-yl]-1-[(Z)-prop-1-enyl]hydrazine

1-[2-[(3E,6E,8Z)-4,6-dimethyldeca-1,3,6,8-tetraen-3-yl]cyclopenta-2,4-dien-1-yl]-1-[(Z)-prop-1-enyl]hydrazine (PubChem CID 166865898) has the molecular formula C20H28N2 and a molecular weight of 296.46 g/mol. Its IUPAC name is 1-[2-[(3E,6E,8Z)-4,6-dimethyldeca-1,3,6,8-tetraen-3-yl]cyclopenta-2,4-dien-1-yl]-1-[(Z)-prop-1-enyl]hydrazine.

Molecular Properties

Compound Name1-[2-[(3E,6E,8Z)-4,6-dimethyldeca-1,3,6,8-tetraen-3-yl]cyclopenta-2,4-dien-1-yl]-1-[(Z)-prop-1-enyl]hydrazine
PubChem CID166865898
Molecular FormulaC20H28N2
Molecular Weight296.46 g/mol
Exact Mass296.23
IUPAC Name1-[2-[(3E,6E,8Z)-4,6-dimethyldeca-1,3,6,8-tetraen-3-yl]cyclopenta-2,4-dien-1-yl]-1-[(Z)-prop-1-enyl]hydrazine
SMILESC=C/C(C1=CC=CC1N(N)/C=C\C)=C(/C)C/C(C)=C/C=C\C
InChIInChI=1S/C20H28N2/c1-6-9-11-16(4)15-17(5)18(8-3)19-12-10-13-20(19)22(21)14-7-2/h6-14,20H,3,15,21H2,1-2,4-5H3/b9-6-,14-7-,16-11+,18-17+
InChIKeyQBFKRSYUCVIRMY-SAWOLABLSA-N
XLogP4.98
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.46
LogP ≤ 54.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-[2-[(3E,6E,8Z)-4,6-dimethyldeca-1,3,6,8-tetraen-3-yl]cyclopenta-2,4-dien-1-yl]-1-[(Z)-prop-1-enyl]hydrazine?
The IUPAC name of 1-[2-[(3E,6E,8Z)-4,6-dimethyldeca-1,3,6,8-tetraen-3-yl]cyclopenta-2,4-dien-1-yl]-1-[(Z)-prop-1-enyl]hydrazine (CID 166865898) is 1-[2-[(3E,6E,8Z)-4,6-dimethyldeca-1,3,6,8-tetraen-3-yl]cyclopenta-2,4-dien-1-yl]-1-[(Z)-prop-1-enyl]hydrazine.
What is the SMILES notation for 1-[2-[(3E,6E,8Z)-4,6-dimethyldeca-1,3,6,8-tetraen-3-yl]cyclopenta-2,4-dien-1-yl]-1-[(Z)-prop-1-enyl]hydrazine?
The canonical SMILES for 1-[2-[(3E,6E,8Z)-4,6-dimethyldeca-1,3,6,8-tetraen-3-yl]cyclopenta-2,4-dien-1-yl]-1-[(Z)-prop-1-enyl]hydrazine is C=C/C(C1=CC=CC1N(N)/C=C\C)=C(/C)C/C(C)=C/C=C\C.
What is the InChIKey of 1-[2-[(3E,6E,8Z)-4,6-dimethyldeca-1,3,6,8-tetraen-3-yl]cyclopenta-2,4-dien-1-yl]-1-[(Z)-prop-1-enyl]hydrazine?
The InChIKey is QBFKRSYUCVIRMY-SAWOLABLSA-N. The full InChI is InChI=1S/C20H28N2/c1-6-9-11-16(4)15-17(5)18(8-3)19-12-10-13-20(19)22(21)14-7-2/h6-14,20H,3,15,21H2,1-2,4-5H3/b9-6-,14-7-,16-11+,18-17+.
What are the key properties of 1-[2-[(3E,6E,8Z)-4,6-dimethyldeca-1,3,6,8-tetraen-3-yl]cyclopenta-2,4-dien-1-yl]-1-[(Z)-prop-1-enyl]hydrazine?
1-[2-[(3E,6E,8Z)-4,6-dimethyldeca-1,3,6,8-tetraen-3-yl]cyclopenta-2,4-dien-1-yl]-1-[(Z)-prop-1-enyl]hydrazine has a molecular weight of 296.46 g/mol, XLogP of 4.98, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[(3E,6E,8Z)-4,6-dimethyldeca-1,3,6,8-tetraen-3-yl]cyclopenta-2,4-dien-1-yl]-1-[(Z)-prop-1-enyl]hydrazine is sourced from PubChem (CID 166865898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).