(5-amino-2-fluoro-4-methoxyphenyl)methanol

C8H10FNO2 — CID 170335540

IUPAC(5-amino-2-fluoro-4-methoxyphenyl)methanol
SMILESCOc1cc(F)c(CO)cc1N
InChIInChI=1S/C8H10FNO2/c1-12-8-3-6(9)5(4-11)2-7(8)10/h2-3,11H,4,10H2,1H3
InChIKeyHGOPURQOOMMYTR-UHFFFAOYSA-N
MW171.17 g/mol
LogP0.91
Rot. Bonds2

About (5-amino-2-fluoro-4-methoxyphenyl)methanol

(5-amino-2-fluoro-4-methoxyphenyl)methanol (PubChem CID 170335540) has the molecular formula C8H10FNO2 and a molecular weight of 171.17 g/mol. Its IUPAC name is (5-amino-2-fluoro-4-methoxyphenyl)methanol.

Molecular Properties

Compound Name(5-amino-2-fluoro-4-methoxyphenyl)methanol
PubChem CID170335540
Molecular FormulaC8H10FNO2
Molecular Weight171.17 g/mol
Exact Mass171.07
IUPAC Name(5-amino-2-fluoro-4-methoxyphenyl)methanol
SMILESCOc1cc(F)c(CO)cc1N
InChIInChI=1S/C8H10FNO2/c1-12-8-3-6(9)5(4-11)2-7(8)10/h2-3,11H,4,10H2,1H3
InChIKeyHGOPURQOOMMYTR-UHFFFAOYSA-N
XLogP0.91
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.17
LogP ≤ 50.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-fluoro-5-methoxybenzene-1,4-diamine
CID 107258755
(4-amino-2-chloro-5-methoxyphenyl)methanol
CID 96834541
4-fluoro-2-methoxy-5-[2-(3,4,5-trimethoxyphenyl)ethyl]aniline
CID 169091123
2,5-difluoro-4-methoxyaniline
CID 45090681
2-fluoro-4-methoxy-5-methylaniline
CID 89371124
1-(5-amino-2-fluoro-4-methoxyphenyl)-2-bromoethanone
CID 171018288
2-fluoro-4-(2-fluoroethoxy)-5-methoxyaniline
CID 171649993
2-fluoro-4-methoxy-5-(2-phenylethyl)aniline
CID 58021975
5-fluoro-4-iodo-2-methoxyaniline
CID 131593338
1-(4-amino-2-fluoro-5-methoxyphenyl)propan-1-one
CID 167626065
1-(4-amino-2-fluoro-5-methoxyphenyl)ethenol
CID 156712123
(2,5-difluoro-4-propoxyphenyl)methanol
CID 164890870

Frequently Asked Questions

What is the IUPAC name of (5-amino-2-fluoro-4-methoxyphenyl)methanol?
The IUPAC name of (5-amino-2-fluoro-4-methoxyphenyl)methanol (CID 170335540) is (5-amino-2-fluoro-4-methoxyphenyl)methanol.
What is the SMILES notation for (5-amino-2-fluoro-4-methoxyphenyl)methanol?
The canonical SMILES for (5-amino-2-fluoro-4-methoxyphenyl)methanol is COc1cc(F)c(CO)cc1N.
What is the InChIKey of (5-amino-2-fluoro-4-methoxyphenyl)methanol?
The InChIKey is HGOPURQOOMMYTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10FNO2/c1-12-8-3-6(9)5(4-11)2-7(8)10/h2-3,11H,4,10H2,1H3.
What are the key properties of (5-amino-2-fluoro-4-methoxyphenyl)methanol?
(5-amino-2-fluoro-4-methoxyphenyl)methanol has a molecular weight of 171.17 g/mol, XLogP of 0.91, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-amino-2-fluoro-4-methoxyphenyl)methanol is sourced from PubChem (CID 170335540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).