(6-ethenyl-4-methyl-3-pyridinyl)methanol

C9H11NO — CID 171542080

IUPAC(6-ethenyl-4-methyl-3-pyridinyl)methanol
SMILESC=Cc1cc(C)c(CO)cn1
InChIInChI=1S/C9H11NO/c1-3-9-4-7(2)8(6-11)5-10-9/h3-5,11H,1,6H2,2H3
InChIKeyXHAIWCQDJJNNTE-UHFFFAOYSA-N
MW149.19 g/mol
LogP1.53
Rot. Bonds2

About (6-ethenyl-4-methyl-3-pyridinyl)methanol

(6-ethenyl-4-methyl-3-pyridinyl)methanol (PubChem CID 171542080) has the molecular formula C9H11NO and a molecular weight of 149.19 g/mol. Its IUPAC name is (6-ethenyl-4-methyl-3-pyridinyl)methanol.

Molecular Properties

Compound Name(6-ethenyl-4-methyl-3-pyridinyl)methanol
PubChem CID171542080
Molecular FormulaC9H11NO
Molecular Weight149.19 g/mol
Exact Mass149.08
IUPAC Name(6-ethenyl-4-methyl-3-pyridinyl)methanol
SMILESC=Cc1cc(C)c(CO)cn1
InChIInChI=1S/C9H11NO/c1-3-9-4-7(2)8(6-11)5-10-9/h3-5,11H,1,6H2,2H3
InChIKeyXHAIWCQDJJNNTE-UHFFFAOYSA-N
XLogP1.53
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.19
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (6-ethenyl-4-methyl-3-pyridinyl)methanol?
The IUPAC name of (6-ethenyl-4-methyl-3-pyridinyl)methanol (CID 171542080) is (6-ethenyl-4-methyl-3-pyridinyl)methanol.
What is the SMILES notation for (6-ethenyl-4-methyl-3-pyridinyl)methanol?
The canonical SMILES for (6-ethenyl-4-methyl-3-pyridinyl)methanol is C=Cc1cc(C)c(CO)cn1.
What is the InChIKey of (6-ethenyl-4-methyl-3-pyridinyl)methanol?
The InChIKey is XHAIWCQDJJNNTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11NO/c1-3-9-4-7(2)8(6-11)5-10-9/h3-5,11H,1,6H2,2H3.
What are the key properties of (6-ethenyl-4-methyl-3-pyridinyl)methanol?
(6-ethenyl-4-methyl-3-pyridinyl)methanol has a molecular weight of 149.19 g/mol, XLogP of 1.53, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6-ethenyl-4-methyl-3-pyridinyl)methanol is sourced from PubChem (CID 171542080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).