(2Z,4E,6Z)-N,4-dimethyl-6-(6-methylidenecyclohexa-2,4-dien-1-ylidene)hexa-2,4-dien-1-imine

C15H17N — CID 88870875

IUPAC(2Z,4E,6Z)-N,4-dimethyl-6-(6-methylidenecyclohexa-2,4-dien-1-ylidene)hexa-2,4-dien-1-imine
SMILESC=c1cccc/c1=C/C=C(C)/C=C\C=N\C
InChIInChI=1S/C15H17N/c1-13(7-6-12-16-3)10-11-15-9-5-4-8-14(15)2/h4-12H,2H2,1,3H3/b7-6-,13-10+,15-11-,16-12+
InChIKeyVYXAKZBHDUWTQX-QEFUHUNCSA-N
MW211.31 g/mol
LogP2.08
Rot. Bonds3

About (2Z,4E,6Z)-N,4-dimethyl-6-(6-methylidenecyclohexa-2,4-dien-1-ylidene)hexa-2,4-dien-1-imine

(2Z,4E,6Z)-N,4-dimethyl-6-(6-methylidenecyclohexa-2,4-dien-1-ylidene)hexa-2,4-dien-1-imine (PubChem CID 88870875) has the molecular formula C15H17N and a molecular weight of 211.31 g/mol. Its IUPAC name is (2Z,4E,6Z)-N,4-dimethyl-6-(6-methylidenecyclohexa-2,4-dien-1-ylidene)hexa-2,4-dien-1-imine.

Molecular Properties

Compound Name(2Z,4E,6Z)-N,4-dimethyl-6-(6-methylidenecyclohexa-2,4-dien-1-ylidene)hexa-2,4-dien-1-imine
PubChem CID88870875
Molecular FormulaC15H17N
Molecular Weight211.31 g/mol
Exact Mass211.14
IUPAC Name(2Z,4E,6Z)-N,4-dimethyl-6-(6-methylidenecyclohexa-2,4-dien-1-ylidene)hexa-2,4-dien-1-imine
SMILESC=c1cccc/c1=C/C=C(C)/C=C\C=N\C
InChIInChI=1S/C15H17N/c1-13(7-6-12-16-3)10-11-15-9-5-4-8-14(15)2/h4-12H,2H2,1,3H3/b7-6-,13-10+,15-11-,16-12+
InChIKeyVYXAKZBHDUWTQX-QEFUHUNCSA-N
XLogP2.08
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 52.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (2Z,4E,6Z)-N,4-dimethyl-6-(6-methylidenecyclohexa-2,4-dien-1-ylidene)hexa-2,4-dien-1-imine?
The IUPAC name of (2Z,4E,6Z)-N,4-dimethyl-6-(6-methylidenecyclohexa-2,4-dien-1-ylidene)hexa-2,4-dien-1-imine (CID 88870875) is (2Z,4E,6Z)-N,4-dimethyl-6-(6-methylidenecyclohexa-2,4-dien-1-ylidene)hexa-2,4-dien-1-imine.
What is the SMILES notation for (2Z,4E,6Z)-N,4-dimethyl-6-(6-methylidenecyclohexa-2,4-dien-1-ylidene)hexa-2,4-dien-1-imine?
The canonical SMILES for (2Z,4E,6Z)-N,4-dimethyl-6-(6-methylidenecyclohexa-2,4-dien-1-ylidene)hexa-2,4-dien-1-imine is C=c1cccc/c1=C/C=C(C)/C=C\C=N\C.
What is the InChIKey of (2Z,4E,6Z)-N,4-dimethyl-6-(6-methylidenecyclohexa-2,4-dien-1-ylidene)hexa-2,4-dien-1-imine?
The InChIKey is VYXAKZBHDUWTQX-QEFUHUNCSA-N. The full InChI is InChI=1S/C15H17N/c1-13(7-6-12-16-3)10-11-15-9-5-4-8-14(15)2/h4-12H,2H2,1,3H3/b7-6-,13-10+,15-11-,16-12+.
What are the key properties of (2Z,4E,6Z)-N,4-dimethyl-6-(6-methylidenecyclohexa-2,4-dien-1-ylidene)hexa-2,4-dien-1-imine?
(2Z,4E,6Z)-N,4-dimethyl-6-(6-methylidenecyclohexa-2,4-dien-1-ylidene)hexa-2,4-dien-1-imine has a molecular weight of 211.31 g/mol, XLogP of 2.08, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z,4E,6Z)-N,4-dimethyl-6-(6-methylidenecyclohexa-2,4-dien-1-ylidene)hexa-2,4-dien-1-imine is sourced from PubChem (CID 88870875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).