(1Z)-1-[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]ethanamine

C10H13N — CID 144667223

IUPAC(1Z)-1-[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]ethanamine
SMILESC/C=c1/cccc/c1=C(\C)N
InChIInChI=1S/C10H13N/c1-3-9-6-4-5-7-10(9)8(2)11/h3-7H,11H2,1-2H3/b9-3-,10-8-
InChIKeyVFYQTFBEZDBSPQ-HJZYTUDGSA-N
MW147.22 g/mol
LogP0.57
Rot. Bonds

About (1Z)-1-[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]ethanamine

(1Z)-1-[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]ethanamine (PubChem CID 144667223) has the molecular formula C10H13N and a molecular weight of 147.22 g/mol. Its IUPAC name is (1Z)-1-[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]ethanamine.

Molecular Properties

Compound Name(1Z)-1-[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]ethanamine
PubChem CID144667223
Molecular FormulaC10H13N
Molecular Weight147.22 g/mol
Exact Mass147.10
IUPAC Name(1Z)-1-[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]ethanamine
SMILESC/C=c1/cccc/c1=C(\C)N
InChIInChI=1S/C10H13N/c1-3-9-6-4-5-7-10(9)8(2)11/h3-7H,11H2,1-2H3/b9-3-,10-8-
InChIKeyVFYQTFBEZDBSPQ-HJZYTUDGSA-N
XLogP0.57
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.22
LogP ≤ 50.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (1Z)-1-[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]ethanamine?
The IUPAC name of (1Z)-1-[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]ethanamine (CID 144667223) is (1Z)-1-[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]ethanamine.
What is the SMILES notation for (1Z)-1-[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]ethanamine?
The canonical SMILES for (1Z)-1-[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]ethanamine is C/C=c1/cccc/c1=C(\C)N.
What is the InChIKey of (1Z)-1-[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]ethanamine?
The InChIKey is VFYQTFBEZDBSPQ-HJZYTUDGSA-N. The full InChI is InChI=1S/C10H13N/c1-3-9-6-4-5-7-10(9)8(2)11/h3-7H,11H2,1-2H3/b9-3-,10-8-.
What are the key properties of (1Z)-1-[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]ethanamine?
(1Z)-1-[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]ethanamine has a molecular weight of 147.22 g/mol, XLogP of 0.57, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1Z)-1-[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]ethanamine is sourced from PubChem (CID 144667223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).