6-(dimethylamino)-6-methylcyclohexa-2,4-dien-1-ol

C9H15NO — CID 70585289

IUPAC6-(dimethylamino)-6-methylcyclohexa-2,4-dien-1-ol
SMILESCN(C)C1(C)C=CC=CC1O
InChIInChI=1S/C9H15NO/c1-9(10(2)3)7-5-4-6-8(9)11/h4-8,11H,1-3H3
InChIKeyPOHFEOSOBIGLQO-UHFFFAOYSA-N
MW153.22 g/mol
LogP0.79
Rot. Bonds1

About 6-(dimethylamino)-6-methylcyclohexa-2,4-dien-1-ol

6-(dimethylamino)-6-methylcyclohexa-2,4-dien-1-ol (PubChem CID 70585289) has the molecular formula C9H15NO and a molecular weight of 153.22 g/mol. Its IUPAC name is 6-(dimethylamino)-6-methylcyclohexa-2,4-dien-1-ol.

Molecular Properties

Compound Name6-(dimethylamino)-6-methylcyclohexa-2,4-dien-1-ol
PubChem CID70585289
Molecular FormulaC9H15NO
Molecular Weight153.22 g/mol
Exact Mass153.12
IUPAC Name6-(dimethylamino)-6-methylcyclohexa-2,4-dien-1-ol
SMILESCN(C)C1(C)C=CC=CC1O
InChIInChI=1S/C9H15NO/c1-9(10(2)3)7-5-4-6-8(9)11/h4-8,11H,1-3H3
InChIKeyPOHFEOSOBIGLQO-UHFFFAOYSA-N
XLogP0.79
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.22
LogP ≤ 50.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-(dimethylamino)-6-methylcyclohexa-2,4-dien-1-ol?
The IUPAC name of 6-(dimethylamino)-6-methylcyclohexa-2,4-dien-1-ol (CID 70585289) is 6-(dimethylamino)-6-methylcyclohexa-2,4-dien-1-ol.
What is the SMILES notation for 6-(dimethylamino)-6-methylcyclohexa-2,4-dien-1-ol?
The canonical SMILES for 6-(dimethylamino)-6-methylcyclohexa-2,4-dien-1-ol is CN(C)C1(C)C=CC=CC1O.
What is the InChIKey of 6-(dimethylamino)-6-methylcyclohexa-2,4-dien-1-ol?
The InChIKey is POHFEOSOBIGLQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO/c1-9(10(2)3)7-5-4-6-8(9)11/h4-8,11H,1-3H3.
What are the key properties of 6-(dimethylamino)-6-methylcyclohexa-2,4-dien-1-ol?
6-(dimethylamino)-6-methylcyclohexa-2,4-dien-1-ol has a molecular weight of 153.22 g/mol, XLogP of 0.79, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(dimethylamino)-6-methylcyclohexa-2,4-dien-1-ol is sourced from PubChem (CID 70585289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).