1-(4,6-dimethyl-3-pyridinyl)ethenol

C9H11NO — CID 177153550

IUPAC1-(4,6-dimethyl-3-pyridinyl)ethenol
SMILESC=C(O)c1cnc(C)cc1C
InChIInChI=1S/C9H11NO/c1-6-4-7(2)10-5-9(6)8(3)11/h4-5,11H,3H2,1-2H3
InChIKeyZJVMAIZQVRFLPJ-UHFFFAOYSA-N
MW149.19 g/mol
LogP2.23
Rot. Bonds1

About 1-(4,6-dimethyl-3-pyridinyl)ethenol

1-(4,6-dimethyl-3-pyridinyl)ethenol (PubChem CID 177153550) has the molecular formula C9H11NO and a molecular weight of 149.19 g/mol. Its IUPAC name is 1-(4,6-dimethyl-3-pyridinyl)ethenol.

Molecular Properties

Compound Name1-(4,6-dimethyl-3-pyridinyl)ethenol
PubChem CID177153550
Molecular FormulaC9H11NO
Molecular Weight149.19 g/mol
Exact Mass149.08
IUPAC Name1-(4,6-dimethyl-3-pyridinyl)ethenol
SMILESC=C(O)c1cnc(C)cc1C
InChIInChI=1S/C9H11NO/c1-6-4-7(2)10-5-9(6)8(3)11/h4-5,11H,3H2,1-2H3
InChIKeyZJVMAIZQVRFLPJ-UHFFFAOYSA-N
XLogP2.23
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.19
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Related Compounds

4,6-dimethylpyridine-3-carboxylic acid
CID 817290
1-(4,6-dimethyl-3-pyridinyl)ethanimine
CID 123920913
2-amino-1-(4,6-dimethyl-3-pyridinyl)propan-1-one
CID 83827929
2-bromo-1-(4,6-dimethyl-3-pyridinyl)propan-1-one
CID 18967827
propan-2-yl 4,6-dimethylpyridine-3-carboxylate
CID 121321019
N,2-dimethyl-5-prop-1-en-2-ylpyridin-4-amine
CID 126725158
[2-(4,6-dimethyl-3-pyridinyl)-2-oxoethyl] formate
CID 174729973
(1S)-1-(4,6-dimethyl-3-pyridinyl)ethanol
CID 130987526
4-ethoxy-6-methylpyridine-3-carboxylic acid
CID 81230098
1-(4,6-dimethyl-3-pyridinyl)hex-4-yn-1-one
CID 131150840
N-(2-methoxyethyl)-4,6-dimethylpyridine-3-carboxamide
CID 123301076
methyl 4-iodo-6-methylpyridine-3-carboxylate
CID 166162841

Frequently Asked Questions

What is the IUPAC name of 1-(4,6-dimethyl-3-pyridinyl)ethenol?
The IUPAC name of 1-(4,6-dimethyl-3-pyridinyl)ethenol (CID 177153550) is 1-(4,6-dimethyl-3-pyridinyl)ethenol.
What is the SMILES notation for 1-(4,6-dimethyl-3-pyridinyl)ethenol?
The canonical SMILES for 1-(4,6-dimethyl-3-pyridinyl)ethenol is C=C(O)c1cnc(C)cc1C.
What is the InChIKey of 1-(4,6-dimethyl-3-pyridinyl)ethenol?
The InChIKey is ZJVMAIZQVRFLPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11NO/c1-6-4-7(2)10-5-9(6)8(3)11/h4-5,11H,3H2,1-2H3.
What are the key properties of 1-(4,6-dimethyl-3-pyridinyl)ethenol?
1-(4,6-dimethyl-3-pyridinyl)ethenol has a molecular weight of 149.19 g/mol, XLogP of 2.23, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4,6-dimethyl-3-pyridinyl)ethenol is sourced from PubChem (CID 177153550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).