(2,6-dimethyl-1H-pyridin-2-yl)methanol

C8H13NO — CID 70247251

IUPAC(2,6-dimethyl-1H-pyridin-2-yl)methanol
SMILESCC1=CC=CC(C)(CO)N1
InChIInChI=1S/C8H13NO/c1-7-4-3-5-8(2,6-10)9-7/h3-5,9-10H,6H2,1-2H3
InChIKeyHIVNVUOFRAFGIF-UHFFFAOYSA-N
MW139.20 g/mol
LogP0.80
Rot. Bonds1

About (2,6-dimethyl-1H-pyridin-2-yl)methanol

(2,6-dimethyl-1H-pyridin-2-yl)methanol (PubChem CID 70247251) has the molecular formula C8H13NO and a molecular weight of 139.20 g/mol. Its IUPAC name is (2,6-dimethyl-1H-pyridin-2-yl)methanol.

Molecular Properties

Compound Name(2,6-dimethyl-1H-pyridin-2-yl)methanol
PubChem CID70247251
Molecular FormulaC8H13NO
Molecular Weight139.20 g/mol
Exact Mass139.10
IUPAC Name(2,6-dimethyl-1H-pyridin-2-yl)methanol
SMILESCC1=CC=CC(C)(CO)N1
InChIInChI=1S/C8H13NO/c1-7-4-3-5-8(2,6-10)9-7/h3-5,9-10H,6H2,1-2H3
InChIKeyHIVNVUOFRAFGIF-UHFFFAOYSA-N
XLogP0.80
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.20
LogP ≤ 50.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2,6-dimethyl-1H-pyridin-2-yl)methanol?
The IUPAC name of (2,6-dimethyl-1H-pyridin-2-yl)methanol (CID 70247251) is (2,6-dimethyl-1H-pyridin-2-yl)methanol.
What is the SMILES notation for (2,6-dimethyl-1H-pyridin-2-yl)methanol?
The canonical SMILES for (2,6-dimethyl-1H-pyridin-2-yl)methanol is CC1=CC=CC(C)(CO)N1.
What is the InChIKey of (2,6-dimethyl-1H-pyridin-2-yl)methanol?
The InChIKey is HIVNVUOFRAFGIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13NO/c1-7-4-3-5-8(2,6-10)9-7/h3-5,9-10H,6H2,1-2H3.
What are the key properties of (2,6-dimethyl-1H-pyridin-2-yl)methanol?
(2,6-dimethyl-1H-pyridin-2-yl)methanol has a molecular weight of 139.20 g/mol, XLogP of 0.80, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2,6-dimethyl-1H-pyridin-2-yl)methanol is sourced from PubChem (CID 70247251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).