[5-(difluoromethyl)-2-methoxy-3-methyl-4-pyridinyl]methanol

C9H11F2NO2 — CID 130087925

IUPAC[5-(difluoromethyl)-2-methoxy-3-methyl-4-pyridinyl]methanol
SMILESCOc1ncc(C(F)F)c(CO)c1C
InChIInChI=1S/C9H11F2NO2/c1-5-7(4-13)6(8(10)11)3-12-9(5)14-2/h3,8,13H,4H2,1-2H3
InChIKeyRNTDGRPRUCXCLN-UHFFFAOYSA-N
MW203.19 g/mol
LogP1.83
Rot. Bonds3

About [5-(difluoromethyl)-2-methoxy-3-methyl-4-pyridinyl]methanol

[5-(difluoromethyl)-2-methoxy-3-methyl-4-pyridinyl]methanol (PubChem CID 130087925) has the molecular formula C9H11F2NO2 and a molecular weight of 203.19 g/mol. Its IUPAC name is [5-(difluoromethyl)-2-methoxy-3-methyl-4-pyridinyl]methanol.

Molecular Properties

Compound Name[5-(difluoromethyl)-2-methoxy-3-methyl-4-pyridinyl]methanol
PubChem CID130087925
Molecular FormulaC9H11F2NO2
Molecular Weight203.19 g/mol
Exact Mass203.08
IUPAC Name[5-(difluoromethyl)-2-methoxy-3-methyl-4-pyridinyl]methanol
SMILESCOc1ncc(C(F)F)c(CO)c1C
InChIInChI=1S/C9H11F2NO2/c1-5-7(4-13)6(8(10)11)3-12-9(5)14-2/h3,8,13H,4H2,1-2H3
InChIKeyRNTDGRPRUCXCLN-UHFFFAOYSA-N
XLogP1.83
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.19
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(bromomethyl)-5-(difluoromethyl)-2-methoxy-3-methylpyridine
CID 130087840
[5-(difluoromethyl)-2-methoxy-3-methyl-4-pyridinyl]methanamine
CID 130087781
[5-(difluoromethyl)-2-methoxy-4-(trifluoromethyl)-3-pyridinyl]methanol
CID 133098904
[2-amino-5-(difluoromethyl)-3-methoxy-4-pyridinyl]methanol
CID 119022056
[4-(chloromethyl)-5-(difluoromethyl)-3-methyl-2-pyridinyl]methanol
CID 130090443
[4-(difluoromethyl)-6-methoxy-5-methyl-2-pyridinyl]methanol
CID 118806611
[5-(difluoromethyl)-3-methoxy-2-nitro-4-pyridinyl]methanol
CID 133100024
2-[4-(aminomethyl)-5-(difluoromethyl)-2-methoxy-3-pyridinyl]acetic acid
CID 133085256
5-(difluoromethyl)-2-methoxy-4-methyl-3-(trifluoromethyl)pyridine
CID 133100579
5-(difluoromethyl)-6-methoxypyridin-3-ol
CID 130096969
4-(bromomethyl)-5-(difluoromethyl)-2-methoxypyridine-3-carbonitrile
CID 130077991
3,4-dichloro-5-(difluoromethyl)-2-methoxypyridine
CID 130099248

Frequently Asked Questions

What is the IUPAC name of [5-(difluoromethyl)-2-methoxy-3-methyl-4-pyridinyl]methanol?
The IUPAC name of [5-(difluoromethyl)-2-methoxy-3-methyl-4-pyridinyl]methanol (CID 130087925) is [5-(difluoromethyl)-2-methoxy-3-methyl-4-pyridinyl]methanol.
What is the SMILES notation for [5-(difluoromethyl)-2-methoxy-3-methyl-4-pyridinyl]methanol?
The canonical SMILES for [5-(difluoromethyl)-2-methoxy-3-methyl-4-pyridinyl]methanol is COc1ncc(C(F)F)c(CO)c1C.
What is the InChIKey of [5-(difluoromethyl)-2-methoxy-3-methyl-4-pyridinyl]methanol?
The InChIKey is RNTDGRPRUCXCLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11F2NO2/c1-5-7(4-13)6(8(10)11)3-12-9(5)14-2/h3,8,13H,4H2,1-2H3.
What are the key properties of [5-(difluoromethyl)-2-methoxy-3-methyl-4-pyridinyl]methanol?
[5-(difluoromethyl)-2-methoxy-3-methyl-4-pyridinyl]methanol has a molecular weight of 203.19 g/mol, XLogP of 1.83, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(difluoromethyl)-2-methoxy-3-methyl-4-pyridinyl]methanol is sourced from PubChem (CID 130087925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).