5,6-bis(aminomethylidene)cyclohexa-1,3-dien-1-ol

C8H10N2O — CID 163516824

IUPAC5,6-bis(aminomethylidene)cyclohexa-1,3-dien-1-ol
SMILESNC=c1cccc(O)c1=CN
InChIInChI=1S/C8H10N2O/c9-4-6-2-1-3-8(11)7(6)5-10/h1-5,11H,9-10H2
InChIKeyDHLUZONNDHOTRF-UHFFFAOYSA-N
MW150.18 g/mol
LogP-1.21
Rot. Bonds

About 5,6-bis(aminomethylidene)cyclohexa-1,3-dien-1-ol

5,6-bis(aminomethylidene)cyclohexa-1,3-dien-1-ol (PubChem CID 163516824) has the molecular formula C8H10N2O and a molecular weight of 150.18 g/mol. Its IUPAC name is 5,6-bis(aminomethylidene)cyclohexa-1,3-dien-1-ol.

Molecular Properties

Compound Name5,6-bis(aminomethylidene)cyclohexa-1,3-dien-1-ol
PubChem CID163516824
Molecular FormulaC8H10N2O
Molecular Weight150.18 g/mol
Exact Mass150.08
IUPAC Name5,6-bis(aminomethylidene)cyclohexa-1,3-dien-1-ol
SMILESNC=c1cccc(O)c1=CN
InChIInChI=1S/C8H10N2O/c9-4-6-2-1-3-8(11)7(6)5-10/h1-5,11H,9-10H2
InChIKeyDHLUZONNDHOTRF-UHFFFAOYSA-N
XLogP-1.21
TPSA72.27 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.18
LogP ≤ 5-1.21
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2,3-Dihydrophthalazin-5-ol
CID 18000385
2H-2-benzazepin-6-ol
CID 18004599
6-(Aminomethylidene)cyclohexa-1,3-dien-1-ol
CID 67159571
2H-2-benzazepin-6-ol;hydrobromide
CID 141074641
4-(Aminomethylidene)cyclohexa-1,5-dien-1-ol
CID 163548670
2H-cyclohepta[c]pyridin-4-ol
CID 171853945
(3E,4Z)-3-(aminomethylidene)hexa-1,4-dien-2-ol
CID 142197497
(3Z,4Z)-3-(aminomethylidene)-4-propylidenecyclohexa-1,5-dien-1-ol
CID 144487599

Frequently Asked Questions

What is the IUPAC name of 5,6-bis(aminomethylidene)cyclohexa-1,3-dien-1-ol?
The IUPAC name of 5,6-bis(aminomethylidene)cyclohexa-1,3-dien-1-ol (CID 163516824) is 5,6-bis(aminomethylidene)cyclohexa-1,3-dien-1-ol.
What is the SMILES notation for 5,6-bis(aminomethylidene)cyclohexa-1,3-dien-1-ol?
The canonical SMILES for 5,6-bis(aminomethylidene)cyclohexa-1,3-dien-1-ol is NC=c1cccc(O)c1=CN.
What is the InChIKey of 5,6-bis(aminomethylidene)cyclohexa-1,3-dien-1-ol?
The InChIKey is DHLUZONNDHOTRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O/c9-4-6-2-1-3-8(11)7(6)5-10/h1-5,11H,9-10H2.
What are the key properties of 5,6-bis(aminomethylidene)cyclohexa-1,3-dien-1-ol?
5,6-bis(aminomethylidene)cyclohexa-1,3-dien-1-ol has a molecular weight of 150.18 g/mol, XLogP of -1.21, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-bis(aminomethylidene)cyclohexa-1,3-dien-1-ol is sourced from PubChem (CID 163516824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).