(Z)-[(6Z)-6-(dimethylaminomethylidene)cyclohexa-2,4-dien-1-ylidene]methanol

C10H13NO — CID 130127715

IUPAC(Z)-[(6Z)-6-(dimethylaminomethylidene)cyclohexa-2,4-dien-1-ylidene]methanol
SMILESCN(C)/C=c1/cccc/c1=C/O
InChIInChI=1S/C10H13NO/c1-11(2)7-9-5-3-4-6-10(9)8-12/h3-8,12H,1-2H3/b9-7-,10-8-
InChIKeyUADWAPUOISIWCN-XOHWUJONSA-N
MW163.22 g/mol
LogP0.28
Rot. Bonds1

About (Z)-[(6Z)-6-(dimethylaminomethylidene)cyclohexa-2,4-dien-1-ylidene]methanol

(Z)-[(6Z)-6-(dimethylaminomethylidene)cyclohexa-2,4-dien-1-ylidene]methanol (PubChem CID 130127715) has the molecular formula C10H13NO and a molecular weight of 163.22 g/mol. Its IUPAC name is (Z)-[(6Z)-6-(dimethylaminomethylidene)cyclohexa-2,4-dien-1-ylidene]methanol.

Molecular Properties

Compound Name(Z)-[(6Z)-6-(dimethylaminomethylidene)cyclohexa-2,4-dien-1-ylidene]methanol
PubChem CID130127715
Molecular FormulaC10H13NO
Molecular Weight163.22 g/mol
Exact Mass163.10
IUPAC Name(Z)-[(6Z)-6-(dimethylaminomethylidene)cyclohexa-2,4-dien-1-ylidene]methanol
SMILESCN(C)/C=c1/cccc/c1=C/O
InChIInChI=1S/C10H13NO/c1-11(2)7-9-5-3-4-6-10(9)8-12/h3-8,12H,1-2H3/b9-7-,10-8-
InChIKeyUADWAPUOISIWCN-XOHWUJONSA-N
XLogP0.28
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.22
LogP ≤ 50.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (Z)-[(6Z)-6-(dimethylaminomethylidene)cyclohexa-2,4-dien-1-ylidene]methanol?
The IUPAC name of (Z)-[(6Z)-6-(dimethylaminomethylidene)cyclohexa-2,4-dien-1-ylidene]methanol (CID 130127715) is (Z)-[(6Z)-6-(dimethylaminomethylidene)cyclohexa-2,4-dien-1-ylidene]methanol.
What is the SMILES notation for (Z)-[(6Z)-6-(dimethylaminomethylidene)cyclohexa-2,4-dien-1-ylidene]methanol?
The canonical SMILES for (Z)-[(6Z)-6-(dimethylaminomethylidene)cyclohexa-2,4-dien-1-ylidene]methanol is CN(C)/C=c1/cccc/c1=C/O.
What is the InChIKey of (Z)-[(6Z)-6-(dimethylaminomethylidene)cyclohexa-2,4-dien-1-ylidene]methanol?
The InChIKey is UADWAPUOISIWCN-XOHWUJONSA-N. The full InChI is InChI=1S/C10H13NO/c1-11(2)7-9-5-3-4-6-10(9)8-12/h3-8,12H,1-2H3/b9-7-,10-8-.
What are the key properties of (Z)-[(6Z)-6-(dimethylaminomethylidene)cyclohexa-2,4-dien-1-ylidene]methanol?
(Z)-[(6Z)-6-(dimethylaminomethylidene)cyclohexa-2,4-dien-1-ylidene]methanol has a molecular weight of 163.22 g/mol, XLogP of 0.28, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-[(6Z)-6-(dimethylaminomethylidene)cyclohexa-2,4-dien-1-ylidene]methanol is sourced from PubChem (CID 130127715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).