1-amino-2-(3-fluoro-5-methylphenyl)propan-2-ol

C10H14FNO — CID 79704426

IUPAC1-amino-2-(3-fluoro-5-methylphenyl)propan-2-ol
SMILESCc1cc(F)cc(C(C)(O)CN)c1
InChIInChI=1S/C10H14FNO/c1-7-3-8(5-9(11)4-7)10(2,13)6-12/h3-5,13H,6,12H2,1-2H3
InChIKeyYINPNWBVJRSLNF-UHFFFAOYSA-N
MW183.23 g/mol
LogP1.30
Rot. Bonds2

About 1-amino-2-(3-fluoro-5-methylphenyl)propan-2-ol

1-amino-2-(3-fluoro-5-methylphenyl)propan-2-ol (PubChem CID 79704426) has the molecular formula C10H14FNO and a molecular weight of 183.23 g/mol. Its IUPAC name is 1-amino-2-(3-fluoro-5-methylphenyl)propan-2-ol.

Molecular Properties

Compound Name1-amino-2-(3-fluoro-5-methylphenyl)propan-2-ol
PubChem CID79704426
Molecular FormulaC10H14FNO
Molecular Weight183.23 g/mol
Exact Mass183.11
IUPAC Name1-amino-2-(3-fluoro-5-methylphenyl)propan-2-ol
SMILESCc1cc(F)cc(C(C)(O)CN)c1
InChIInChI=1S/C10H14FNO/c1-7-3-8(5-9(11)4-7)10(2,13)6-12/h3-5,13H,6,12H2,1-2H3
InChIKeyYINPNWBVJRSLNF-UHFFFAOYSA-N
XLogP1.30
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.23
LogP ≤ 51.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(ethylamino)-2-(3-fluoro-5-methylphenyl)propan-2-ol
CID 79704574
2-(3-fluoro-5-methylphenyl)-1-(4-fluorophenyl)propan-2-ol
CID 114832963
1-(cyclopropylamino)-2-(3-fluoro-5-methylphenyl)propan-2-ol
CID 79704774
2-(3-fluoro-5-methylphenyl)-3,3-dimethylbutan-2-ol
CID 115401195
(3S)-3-amino-3-(3-fluoro-5-methylphenyl)butan-1-ol
CID 130706389
2-(3-fluoro-5-methylphenyl)-3-methylpentan-2-ol
CID 79692026
1-(3-fluoro-5-methylphenyl)-1-(4-methylphenyl)ethanol
CID 79691276
(2R)-2-amino-2-(3-fluoro-5-methylphenyl)propanoic acid
CID 130657350
1-amino-2-[4-(trifluoromethyl)phenyl]propan-2-ol
CID 62774941
2-(3,5-dimethylphenyl)-2-fluoropropan-1-amine
CID 112565200
4-(3-fluoro-5-methylphenyl)-4-methylpentan-2-one
CID 79704554
1-(3,4-dimethylphenyl)-1-(3-fluoro-5-methylphenyl)ethanol
CID 79692579

Frequently Asked Questions

What is the IUPAC name of 1-amino-2-(3-fluoro-5-methylphenyl)propan-2-ol?
The IUPAC name of 1-amino-2-(3-fluoro-5-methylphenyl)propan-2-ol (CID 79704426) is 1-amino-2-(3-fluoro-5-methylphenyl)propan-2-ol.
What is the SMILES notation for 1-amino-2-(3-fluoro-5-methylphenyl)propan-2-ol?
The canonical SMILES for 1-amino-2-(3-fluoro-5-methylphenyl)propan-2-ol is Cc1cc(F)cc(C(C)(O)CN)c1.
What is the InChIKey of 1-amino-2-(3-fluoro-5-methylphenyl)propan-2-ol?
The InChIKey is YINPNWBVJRSLNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14FNO/c1-7-3-8(5-9(11)4-7)10(2,13)6-12/h3-5,13H,6,12H2,1-2H3.
What are the key properties of 1-amino-2-(3-fluoro-5-methylphenyl)propan-2-ol?
1-amino-2-(3-fluoro-5-methylphenyl)propan-2-ol has a molecular weight of 183.23 g/mol, XLogP of 1.30, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-2-(3-fluoro-5-methylphenyl)propan-2-ol is sourced from PubChem (CID 79704426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).