(5Z,6Z)-6-(1-aminoethylidene)-5-ethylidenecyclohexa-1,3-dien-1-ol

C10H13NO — CID 143741357

IUPAC(5Z,6Z)-6-(1-aminoethylidene)-5-ethylidenecyclohexa-1,3-dien-1-ol
SMILESC/C=c1/cccc(O)/c1=C(/C)N
InChIInChI=1S/C10H13NO/c1-3-8-5-4-6-9(12)10(8)7(2)11/h3-6,12H,11H2,1-2H3/b8-3-,10-7-
InChIKeyACOMMXYDHXHMMQ-CYBIAPKUSA-N
MW163.22 g/mol
LogP0.28
Rot. Bonds

About (5Z,6Z)-6-(1-aminoethylidene)-5-ethylidenecyclohexa-1,3-dien-1-ol

(5Z,6Z)-6-(1-aminoethylidene)-5-ethylidenecyclohexa-1,3-dien-1-ol (PubChem CID 143741357) has the molecular formula C10H13NO and a molecular weight of 163.22 g/mol. Its IUPAC name is (5Z,6Z)-6-(1-aminoethylidene)-5-ethylidenecyclohexa-1,3-dien-1-ol.

Molecular Properties

Compound Name(5Z,6Z)-6-(1-aminoethylidene)-5-ethylidenecyclohexa-1,3-dien-1-ol
PubChem CID143741357
Molecular FormulaC10H13NO
Molecular Weight163.22 g/mol
Exact Mass163.10
IUPAC Name(5Z,6Z)-6-(1-aminoethylidene)-5-ethylidenecyclohexa-1,3-dien-1-ol
SMILESC/C=c1/cccc(O)/c1=C(/C)N
InChIInChI=1S/C10H13NO/c1-3-8-5-4-6-9(12)10(8)7(2)11/h3-6,12H,11H2,1-2H3/b8-3-,10-7-
InChIKeyACOMMXYDHXHMMQ-CYBIAPKUSA-N
XLogP0.28
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.22
LogP ≤ 50.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (5Z,6Z)-6-(1-aminoethylidene)-5-ethylidenecyclohexa-1,3-dien-1-ol?
The IUPAC name of (5Z,6Z)-6-(1-aminoethylidene)-5-ethylidenecyclohexa-1,3-dien-1-ol (CID 143741357) is (5Z,6Z)-6-(1-aminoethylidene)-5-ethylidenecyclohexa-1,3-dien-1-ol.
What is the SMILES notation for (5Z,6Z)-6-(1-aminoethylidene)-5-ethylidenecyclohexa-1,3-dien-1-ol?
The canonical SMILES for (5Z,6Z)-6-(1-aminoethylidene)-5-ethylidenecyclohexa-1,3-dien-1-ol is C/C=c1/cccc(O)/c1=C(/C)N.
What is the InChIKey of (5Z,6Z)-6-(1-aminoethylidene)-5-ethylidenecyclohexa-1,3-dien-1-ol?
The InChIKey is ACOMMXYDHXHMMQ-CYBIAPKUSA-N. The full InChI is InChI=1S/C10H13NO/c1-3-8-5-4-6-9(12)10(8)7(2)11/h3-6,12H,11H2,1-2H3/b8-3-,10-7-.
What are the key properties of (5Z,6Z)-6-(1-aminoethylidene)-5-ethylidenecyclohexa-1,3-dien-1-ol?
(5Z,6Z)-6-(1-aminoethylidene)-5-ethylidenecyclohexa-1,3-dien-1-ol has a molecular weight of 163.22 g/mol, XLogP of 0.28, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5Z,6Z)-6-(1-aminoethylidene)-5-ethylidenecyclohexa-1,3-dien-1-ol is sourced from PubChem (CID 143741357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).