6-(diethylaminomethylidene)cyclohexa-2,4-dien-1-ol

C11H17NO — CID 139972799

IUPAC6-(diethylaminomethylidene)cyclohexa-2,4-dien-1-ol
SMILESCCN(C=C1C=CC=CC1O)CC
InChIInChI=1S/C11H17NO/c1-3-12(4-2)9-10-7-5-6-8-11(10)13/h5-9,11,13H,3-4H2,1-2H3
InChIKeyISMGASBMEMTCTL-UHFFFAOYSA-N
MW179.26 g/mol
LogP1.70
Rot. Bonds3

About 6-(diethylaminomethylidene)cyclohexa-2,4-dien-1-ol

6-(diethylaminomethylidene)cyclohexa-2,4-dien-1-ol (PubChem CID 139972799) has the molecular formula C11H17NO and a molecular weight of 179.26 g/mol. Its IUPAC name is 6-(diethylaminomethylidene)cyclohexa-2,4-dien-1-ol.

Molecular Properties

Compound Name6-(diethylaminomethylidene)cyclohexa-2,4-dien-1-ol
PubChem CID139972799
Molecular FormulaC11H17NO
Molecular Weight179.26 g/mol
Exact Mass179.13
IUPAC Name6-(diethylaminomethylidene)cyclohexa-2,4-dien-1-ol
SMILESCCN(C=C1C=CC=CC1O)CC
InChIInChI=1S/C11H17NO/c1-3-12(4-2)9-10-7-5-6-8-11(10)13/h5-9,11,13H,3-4H2,1-2H3
InChIKeyISMGASBMEMTCTL-UHFFFAOYSA-N
XLogP1.70
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.26
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(N,N-diethylaminomethyl)-2,4-dimethylphenol
CID 129706337
2,6-Bis(dimethylaminomethylidene)-4-methylcyclohex-3-en-1-ol
CID 53799286
5-(5-methoxy-1-methyl-2H-pyridin-3-yl)pent-4-en-2-ol
CID 66745989
[4-(Diethylamino)cyclohexa-1,5-dien-1-yl]methanol
CID 68213053
1-[1-(1-hydroxyethyl)-2H-pyridin-5-yl]ethanol
CID 69454317
6-(Diethylaminomethyl)-3,6-dimethylcyclohexa-2,4-dien-1-ol
CID 70397430
1,4-bis(prop-2-enyl)-2H-pyridin-2-ol
CID 70408765
(1-methyl-2H-pyridin-5-yl)methanol
CID 70426230
5-[Butyl(propyl)amino]cyclohexa-2,4-dien-1-ol
CID 70845294
4E-N-methyl-5-(5-methoxy-3-pyridyl)-4-penten-2ol
CID 86585127
lithium N,N-dimethyl-2-aminomethylene-4-methylphenoxide
CID 86750153
N,N-Dimethyl-2-aminomethylene-4-methylpheno1
CID 86750154

Frequently Asked Questions

What is the IUPAC name of 6-(diethylaminomethylidene)cyclohexa-2,4-dien-1-ol?
The IUPAC name of 6-(diethylaminomethylidene)cyclohexa-2,4-dien-1-ol (CID 139972799) is 6-(diethylaminomethylidene)cyclohexa-2,4-dien-1-ol.
What is the SMILES notation for 6-(diethylaminomethylidene)cyclohexa-2,4-dien-1-ol?
The canonical SMILES for 6-(diethylaminomethylidene)cyclohexa-2,4-dien-1-ol is CCN(C=C1C=CC=CC1O)CC.
What is the InChIKey of 6-(diethylaminomethylidene)cyclohexa-2,4-dien-1-ol?
The InChIKey is ISMGASBMEMTCTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO/c1-3-12(4-2)9-10-7-5-6-8-11(10)13/h5-9,11,13H,3-4H2,1-2H3.
What are the key properties of 6-(diethylaminomethylidene)cyclohexa-2,4-dien-1-ol?
6-(diethylaminomethylidene)cyclohexa-2,4-dien-1-ol has a molecular weight of 179.26 g/mol, XLogP of 1.70, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(diethylaminomethylidene)cyclohexa-2,4-dien-1-ol is sourced from PubChem (CID 139972799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).