6-(difluoromethyl)-2-ethyl-1-methyl-2H-pyridin-3-ol

C9H13F2NO — CID 141220732

IUPAC6-(difluoromethyl)-2-ethyl-1-methyl-2H-pyridin-3-ol
SMILESCCC1C(O)=CC=C(C(F)F)N1C
InChIInChI=1S/C9H13F2NO/c1-3-6-8(13)5-4-7(9(10)11)12(6)2/h4-6,9,13H,3H2,1-2H3
InChIKeyFZOWHKSTBBKUJI-UHFFFAOYSA-N
MW189.21 g/mol
LogP2.30
Rot. Bonds2

About 6-(difluoromethyl)-2-ethyl-1-methyl-2H-pyridin-3-ol

6-(difluoromethyl)-2-ethyl-1-methyl-2H-pyridin-3-ol (PubChem CID 141220732) has the molecular formula C9H13F2NO and a molecular weight of 189.21 g/mol. Its IUPAC name is 6-(difluoromethyl)-2-ethyl-1-methyl-2H-pyridin-3-ol.

Molecular Properties

Compound Name6-(difluoromethyl)-2-ethyl-1-methyl-2H-pyridin-3-ol
PubChem CID141220732
Molecular FormulaC9H13F2NO
Molecular Weight189.21 g/mol
Exact Mass189.10
IUPAC Name6-(difluoromethyl)-2-ethyl-1-methyl-2H-pyridin-3-ol
SMILESCCC1C(O)=CC=C(C(F)F)N1C
InChIInChI=1S/C9H13F2NO/c1-3-6-8(13)5-4-7(9(10)11)12(6)2/h4-6,9,13H,3H2,1-2H3
InChIKeyFZOWHKSTBBKUJI-UHFFFAOYSA-N
XLogP2.30
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.21
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-(difluoromethyl)-1,2-dimethyl-2H-pyridin-3-ol
CID 141220741
2-(difluoromethyl)-1-methyl-2H-pyridin-3-ol
CID 141220745
1,2-dimethyl-6-(2,2,2-trifluoroethyl)-2H-pyridin-3-ol
CID 141220747
2-[(dimethylamino)methyl]-1-(2,2,2-trifluoroethyl)-2H-pyridin-3-ol
CID 141299345
5-[1-(dimethylamino)-2,2,2-trifluoroethyl]-1,2-dimethyl-2H-pyridin-3-ol
CID 141299348
2-[(dimethylamino)methyl]-6-methyl-1-(2,2,2-trifluoroethyl)-2H-pyridin-3-ol
CID 141299351
2-(dimethylamino)-1-methyl-6-(2,2,2-trifluoroethyl)-2H-pyridin-3-ol
CID 141299358
1-(2,2-difluoroethyl)-2-[(dimethylamino)methyl]-6-methyl-2H-pyridin-3-ol
CID 141299363
6-(difluoromethyl)-2-(hydroxymethyl)-1-methyl-2H-pyridin-3-ol
CID 149751276
1,2-diethyl-2H-pyridin-3-ol
CID 160789382

Frequently Asked Questions

What is the IUPAC name of 6-(difluoromethyl)-2-ethyl-1-methyl-2H-pyridin-3-ol?
The IUPAC name of 6-(difluoromethyl)-2-ethyl-1-methyl-2H-pyridin-3-ol (CID 141220732) is 6-(difluoromethyl)-2-ethyl-1-methyl-2H-pyridin-3-ol.
What is the SMILES notation for 6-(difluoromethyl)-2-ethyl-1-methyl-2H-pyridin-3-ol?
The canonical SMILES for 6-(difluoromethyl)-2-ethyl-1-methyl-2H-pyridin-3-ol is CCC1C(O)=CC=C(C(F)F)N1C.
What is the InChIKey of 6-(difluoromethyl)-2-ethyl-1-methyl-2H-pyridin-3-ol?
The InChIKey is FZOWHKSTBBKUJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13F2NO/c1-3-6-8(13)5-4-7(9(10)11)12(6)2/h4-6,9,13H,3H2,1-2H3.
What are the key properties of 6-(difluoromethyl)-2-ethyl-1-methyl-2H-pyridin-3-ol?
6-(difluoromethyl)-2-ethyl-1-methyl-2H-pyridin-3-ol has a molecular weight of 189.21 g/mol, XLogP of 2.30, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(difluoromethyl)-2-ethyl-1-methyl-2H-pyridin-3-ol is sourced from PubChem (CID 141220732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).