[3-(difluoromethyl)-4-pyridinyl]methanol

C7H7F2NO — CID 130094486

IUPAC[3-(difluoromethyl)-4-pyridinyl]methanol
SMILESOCc1ccncc1C(F)F
InChIInChI=1S/C7H7F2NO/c8-7(9)6-3-10-2-1-5(6)4-11/h1-3,7,11H,4H2
InChIKeyAFRUFHLZDZGJKX-UHFFFAOYSA-N
MW159.14 g/mol
LogP1.51
Rot. Bonds2

About [3-(difluoromethyl)-4-pyridinyl]methanol

[3-(difluoromethyl)-4-pyridinyl]methanol (PubChem CID 130094486) has the molecular formula C7H7F2NO and a molecular weight of 159.14 g/mol. Its IUPAC name is [3-(difluoromethyl)-4-pyridinyl]methanol.

Molecular Properties

Compound Name[3-(difluoromethyl)-4-pyridinyl]methanol
PubChem CID130094486
Molecular FormulaC7H7F2NO
Molecular Weight159.14 g/mol
Exact Mass159.05
IUPAC Name[3-(difluoromethyl)-4-pyridinyl]methanol
SMILESOCc1ccncc1C(F)F
InChIInChI=1S/C7H7F2NO/c8-7(9)6-3-10-2-1-5(6)4-11/h1-3,7,11H,4H2
InChIKeyAFRUFHLZDZGJKX-UHFFFAOYSA-N
XLogP1.51
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.14
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(4-iodo-3-pyridinyl)methanol
CID 119092620
[4-(bromomethyl)-3-pyridinyl]methanol
CID 139484815
2-(difluoromethyl)-4-(hydroxymethyl)pyridin-3-ol
CID 118820346
ethane;(4-ethyl-3-pyridinyl)methanol;propane
CID 142370025
[4-(difluoromethyl)-2-pyridin-4-ylpyrimidin-5-yl]methanol
CID 114205186
(4-bromo-3-pyridinyl)methanol;hydrochloride
CID 71669148
methyl 4-(difluoromethyl)pyridine-3-carboxylate
CID 97181391
[3-(hydroxymethyl)-4-pyridinyl]-phenylmethanol
CID 59205218
(3-amino-4-pyridinyl)methanol;chloroform;dioxomanganese
CID 159501556
[3-(diethylamino)-4-pyridinyl]methanol
CID 105066644
[6-amino-4-(difluoromethyl)-3-pyridinyl]methanol
CID 119013180
(2R)-2-amino-2-(4-chloro-3-pyridinyl)ethanol
CID 130738472

Frequently Asked Questions

What is the IUPAC name of [3-(difluoromethyl)-4-pyridinyl]methanol?
The IUPAC name of [3-(difluoromethyl)-4-pyridinyl]methanol (CID 130094486) is [3-(difluoromethyl)-4-pyridinyl]methanol.
What is the SMILES notation for [3-(difluoromethyl)-4-pyridinyl]methanol?
The canonical SMILES for [3-(difluoromethyl)-4-pyridinyl]methanol is OCc1ccncc1C(F)F.
What is the InChIKey of [3-(difluoromethyl)-4-pyridinyl]methanol?
The InChIKey is AFRUFHLZDZGJKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7F2NO/c8-7(9)6-3-10-2-1-5(6)4-11/h1-3,7,11H,4H2.
What are the key properties of [3-(difluoromethyl)-4-pyridinyl]methanol?
[3-(difluoromethyl)-4-pyridinyl]methanol has a molecular weight of 159.14 g/mol, XLogP of 1.51, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(difluoromethyl)-4-pyridinyl]methanol is sourced from PubChem (CID 130094486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).