1-amino-3-(2-fluoro-6-methoxyphenyl)propan-2-ol

C10H14FNO2 — CID 83442464

IUPAC1-amino-3-(2-fluoro-6-methoxyphenyl)propan-2-ol
SMILESCOc1cccc(F)c1CC(O)CN
InChIInChI=1S/C10H14FNO2/c1-14-10-4-2-3-9(11)8(10)5-7(13)6-12/h2-4,7,13H,5-6,12H2,1H3
InChIKeyLQHMKJWZWZSNDF-UHFFFAOYSA-N
MW199.23 g/mol
LogP0.70
Rot. Bonds4

About 1-amino-3-(2-fluoro-6-methoxyphenyl)propan-2-ol

1-amino-3-(2-fluoro-6-methoxyphenyl)propan-2-ol (PubChem CID 83442464) has the molecular formula C10H14FNO2 and a molecular weight of 199.23 g/mol. Its IUPAC name is 1-amino-3-(2-fluoro-6-methoxyphenyl)propan-2-ol.

Molecular Properties

Compound Name1-amino-3-(2-fluoro-6-methoxyphenyl)propan-2-ol
PubChem CID83442464
Molecular FormulaC10H14FNO2
Molecular Weight199.23 g/mol
Exact Mass199.10
IUPAC Name1-amino-3-(2-fluoro-6-methoxyphenyl)propan-2-ol
SMILESCOc1cccc(F)c1CC(O)CN
InChIInChI=1S/C10H14FNO2/c1-14-10-4-2-3-9(11)8(10)5-7(13)6-12/h2-4,7,13H,5-6,12H2,1H3
InChIKeyLQHMKJWZWZSNDF-UHFFFAOYSA-N
XLogP0.70
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.23
LogP ≤ 50.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2-fluoro-6-methoxyphenyl)methanamine
CID 40786958
methyl 2-amino-3-(2-fluoro-6-methoxyphenyl)propanoate
CID 83810004
1-(2-fluoro-6-methoxyphenyl)butan-2-amine;hydrochloride
CID 170889150
3-(2-fluoro-6-methoxyphenyl)-2,2-dimethylpropan-1-amine
CID 83808865
1-amino-3-(4-fluoro-3-methoxyphenyl)propan-2-ol
CID 82397890
3-amino-1-(2-fluoro-6-methoxyphenyl)-2-methylpropan-1-ol
CID 65434086
1-(tert-butylamino)-3-(2,6-difluorophenyl)propan-2-ol
CID 114934806
1-(2-fluorophenyl)-3-(2-methoxyphenyl)propan-2-ol
CID 61263658
1-amino-3-(2-fluorophenyl)propan-2-ol
CID 64982726
1-(2-chloro-6-fluorophenyl)-3-(3-fluoro-4-methoxyphenyl)propan-2-ol
CID 63022137
CID 59280730
CID 59280730
1-(2,6-dimethoxyphenyl)-2-(2-fluorophenyl)ethanol
CID 63018085

Frequently Asked Questions

What is the IUPAC name of 1-amino-3-(2-fluoro-6-methoxyphenyl)propan-2-ol?
The IUPAC name of 1-amino-3-(2-fluoro-6-methoxyphenyl)propan-2-ol (CID 83442464) is 1-amino-3-(2-fluoro-6-methoxyphenyl)propan-2-ol.
What is the SMILES notation for 1-amino-3-(2-fluoro-6-methoxyphenyl)propan-2-ol?
The canonical SMILES for 1-amino-3-(2-fluoro-6-methoxyphenyl)propan-2-ol is COc1cccc(F)c1CC(O)CN.
What is the InChIKey of 1-amino-3-(2-fluoro-6-methoxyphenyl)propan-2-ol?
The InChIKey is LQHMKJWZWZSNDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14FNO2/c1-14-10-4-2-3-9(11)8(10)5-7(13)6-12/h2-4,7,13H,5-6,12H2,1H3.
What are the key properties of 1-amino-3-(2-fluoro-6-methoxyphenyl)propan-2-ol?
1-amino-3-(2-fluoro-6-methoxyphenyl)propan-2-ol has a molecular weight of 199.23 g/mol, XLogP of 0.70, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-3-(2-fluoro-6-methoxyphenyl)propan-2-ol is sourced from PubChem (CID 83442464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).