ethane;1-(2-fluoro-4-methyl-3-pyridinyl)ethanol

C10H16FNO — CID 143814880

IUPACethane;1-(2-fluoro-4-methyl-3-pyridinyl)ethanol
SMILESCC.Cc1ccnc(F)c1C(C)O
InChIInChI=1S/C8H10FNO.C2H6/c1-5-3-4-10-8(9)7(5)6(2)11;1-2/h3-4,6,11H,1-2H3;1-2H3
InChIKeyKRYOZBOACUXNQT-UHFFFAOYSA-N
MW185.24 g/mol
LogP2.61
Rot. Bonds1

About ethane;1-(2-fluoro-4-methyl-3-pyridinyl)ethanol

ethane;1-(2-fluoro-4-methyl-3-pyridinyl)ethanol (PubChem CID 143814880) has the molecular formula C10H16FNO and a molecular weight of 185.24 g/mol. Its IUPAC name is ethane;1-(2-fluoro-4-methyl-3-pyridinyl)ethanol.

Molecular Properties

Compound Nameethane;1-(2-fluoro-4-methyl-3-pyridinyl)ethanol
PubChem CID143814880
Molecular FormulaC10H16FNO
Molecular Weight185.24 g/mol
Exact Mass185.12
IUPAC Nameethane;1-(2-fluoro-4-methyl-3-pyridinyl)ethanol
SMILESCC.Cc1ccnc(F)c1C(C)O
InChIInChI=1S/C8H10FNO.C2H6/c1-5-3-4-10-8(9)7(5)6(2)11;1-2/h3-4,6,11H,1-2H3;1-2H3
InChIKeyKRYOZBOACUXNQT-UHFFFAOYSA-N
XLogP2.61
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.24
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

cyclopropyl-(2-fluoro-4-methyl-3-pyridinyl)methanol
CID 176820199
(1S)-1-(4-fluoro-2,6-dimethylphenyl)ethanol
CID 106880220
2-fluoro-3-methoxy-4-methylpyridine
CID 123887347
2,3-bis(1-hydroxyethyl)-4-methylphenol
CID 22486739
(2-amino-4-methyl-3-pyridinyl)-[3-(difluoromethyl)phenyl]methanol
CID 115527804
1-[2-fluoro-6-(4-methylpyrimidin-2-yl)sulfanylphenyl]ethanol
CID 63835947
4-bromo-2-fluoro-3-methylpyridine;ethane
CID 143380357
1-(2,6-difluorophenyl)ethanol
CID 5012075
3-(difluoromethyl)-4-methylpyridine-2-carbonyl chloride
CID 130097794
1-(4-methylquinolin-6-yl)ethanol
CID 82575956
1-(4-methylquinolin-8-yl)ethanol
CID 82575957
(2-amino-4-methyl-3-pyridinyl)-(3,3-difluorocyclohexyl)methanol
CID 114215752

Frequently Asked Questions

What is the IUPAC name of ethane;1-(2-fluoro-4-methyl-3-pyridinyl)ethanol?
The IUPAC name of ethane;1-(2-fluoro-4-methyl-3-pyridinyl)ethanol (CID 143814880) is ethane;1-(2-fluoro-4-methyl-3-pyridinyl)ethanol.
What is the SMILES notation for ethane;1-(2-fluoro-4-methyl-3-pyridinyl)ethanol?
The canonical SMILES for ethane;1-(2-fluoro-4-methyl-3-pyridinyl)ethanol is CC.Cc1ccnc(F)c1C(C)O.
What is the InChIKey of ethane;1-(2-fluoro-4-methyl-3-pyridinyl)ethanol?
The InChIKey is KRYOZBOACUXNQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10FNO.C2H6/c1-5-3-4-10-8(9)7(5)6(2)11;1-2/h3-4,6,11H,1-2H3;1-2H3.
What are the key properties of ethane;1-(2-fluoro-4-methyl-3-pyridinyl)ethanol?
ethane;1-(2-fluoro-4-methyl-3-pyridinyl)ethanol has a molecular weight of 185.24 g/mol, XLogP of 2.61, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1-(2-fluoro-4-methyl-3-pyridinyl)ethanol is sourced from PubChem (CID 143814880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).