amino-[6-(2-fluoro-6-methoxyphenyl)-2-pyridinyl]methanol

C13H13FN2O2 — CID 170082323

IUPACamino-[6-(2-fluoro-6-methoxyphenyl)-2-pyridinyl]methanol
SMILESCOc1cccc(F)c1-c1cccc(C(N)O)n1
InChIInChI=1S/C13H13FN2O2/c1-18-11-7-2-4-8(14)12(11)9-5-3-6-10(16-9)13(15)17/h2-7,13,17H,15H2,1H3
InChIKeyWPBAQUXYZJCYCN-UHFFFAOYSA-N
MW248.26 g/mol
LogP1.85
Rot. Bonds3

About amino-[6-(2-fluoro-6-methoxyphenyl)-2-pyridinyl]methanol

amino-[6-(2-fluoro-6-methoxyphenyl)-2-pyridinyl]methanol (PubChem CID 170082323) has the molecular formula C13H13FN2O2 and a molecular weight of 248.26 g/mol. Its IUPAC name is amino-[6-(2-fluoro-6-methoxyphenyl)-2-pyridinyl]methanol.

Molecular Properties

Compound Nameamino-[6-(2-fluoro-6-methoxyphenyl)-2-pyridinyl]methanol
PubChem CID170082323
Molecular FormulaC13H13FN2O2
Molecular Weight248.26 g/mol
Exact Mass248.10
IUPAC Nameamino-[6-(2-fluoro-6-methoxyphenyl)-2-pyridinyl]methanol
SMILESCOc1cccc(F)c1-c1cccc(C(N)O)n1
InChIInChI=1S/C13H13FN2O2/c1-18-11-7-2-4-8(14)12(11)9-5-3-6-10(16-9)13(15)17/h2-7,13,17H,15H2,1H3
InChIKeyWPBAQUXYZJCYCN-UHFFFAOYSA-N
XLogP1.85
TPSA68.37 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.26
LogP ≤ 51.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

2-(2-fluoro-6-methoxyphenyl)pyridine
CID 66942163
4-(2-fluoro-6-methoxyphenyl)-1,3-thiazole-2-carboxamide
CID 168988816
2-amino-1-(2-fluoro-6-methoxyphenyl)propan-1-one
CID 83808441
2-(2-fluoro-6-methoxyphenyl)-6,7-dimethoxy-4-methylquinoline
CID 169418540
1-fluoro-2-(2-fluorophenyl)-3-methoxybenzene
CID 46312197
2-(2,6-dimethoxyphenyl)-6-fluoroaniline
CID 107602899
2-[4-(2-fluoro-6-methoxyphenyl)phenyl]-2-methylpropanamide
CID 56713578
5-ethyl-3-(2-fluoro-6-methoxyphenyl)-1H-1,2,4-triazole
CID 65432102
3-(2-fluoro-6-methoxyphenyl)-4-methyl-1H-1,2,4-triazole-5-thione
CID 115389344
(1S)-1-(2-fluoro-6-methoxyphenyl)propane-1,3-diamine
CID 171230221
4-fluoro-5-methoxy-9H-fluoren-9-amine
CID 82578577
(1S)-2-fluoro-1-(2-fluoro-6-methoxyphenyl)ethanamine;hydrochloride
CID 171210621

Frequently Asked Questions

What is the IUPAC name of amino-[6-(2-fluoro-6-methoxyphenyl)-2-pyridinyl]methanol?
The IUPAC name of amino-[6-(2-fluoro-6-methoxyphenyl)-2-pyridinyl]methanol (CID 170082323) is amino-[6-(2-fluoro-6-methoxyphenyl)-2-pyridinyl]methanol.
What is the SMILES notation for amino-[6-(2-fluoro-6-methoxyphenyl)-2-pyridinyl]methanol?
The canonical SMILES for amino-[6-(2-fluoro-6-methoxyphenyl)-2-pyridinyl]methanol is COc1cccc(F)c1-c1cccc(C(N)O)n1.
What is the InChIKey of amino-[6-(2-fluoro-6-methoxyphenyl)-2-pyridinyl]methanol?
The InChIKey is WPBAQUXYZJCYCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13FN2O2/c1-18-11-7-2-4-8(14)12(11)9-5-3-6-10(16-9)13(15)17/h2-7,13,17H,15H2,1H3.
What are the key properties of amino-[6-(2-fluoro-6-methoxyphenyl)-2-pyridinyl]methanol?
amino-[6-(2-fluoro-6-methoxyphenyl)-2-pyridinyl]methanol has a molecular weight of 248.26 g/mol, XLogP of 1.85, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for amino-[6-(2-fluoro-6-methoxyphenyl)-2-pyridinyl]methanol is sourced from PubChem (CID 170082323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).