1-(ethylamino)-2-(3-fluorophenyl)propan-2-ol

C11H16FNO — CID 62775143

IUPAC1-(ethylamino)-2-(3-fluorophenyl)propan-2-ol
SMILESCCNCC(C)(O)c1cccc(F)c1
InChIInChI=1S/C11H16FNO/c1-3-13-8-11(2,14)9-5-4-6-10(12)7-9/h4-7,13-14H,3,8H2,1-2H3
InChIKeyDIRKXKDGRIJQBY-UHFFFAOYSA-N
MW197.25 g/mol
LogP1.64
Rot. Bonds4

About 1-(ethylamino)-2-(3-fluorophenyl)propan-2-ol

1-(ethylamino)-2-(3-fluorophenyl)propan-2-ol (PubChem CID 62775143) has the molecular formula C11H16FNO and a molecular weight of 197.25 g/mol. Its IUPAC name is 1-(ethylamino)-2-(3-fluorophenyl)propan-2-ol.

Molecular Properties

Compound Name1-(ethylamino)-2-(3-fluorophenyl)propan-2-ol
PubChem CID62775143
Molecular FormulaC11H16FNO
Molecular Weight197.25 g/mol
Exact Mass197.12
IUPAC Name1-(ethylamino)-2-(3-fluorophenyl)propan-2-ol
SMILESCCNCC(C)(O)c1cccc(F)c1
InChIInChI=1S/C11H16FNO/c1-3-13-8-11(2,14)9-5-4-6-10(12)7-9/h4-7,13-14H,3,8H2,1-2H3
InChIKeyDIRKXKDGRIJQBY-UHFFFAOYSA-N
XLogP1.64
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.25
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-bromophenyl)-1-(ethylamino)propan-2-ol
CID 62773970
(2S)-2-(3-fluorophenyl)pentan-2-ol
CID 93299056
2-(3-fluorophenyl)-1-(propan-2-ylamino)propan-2-ol
CID 62773399
1-(ethylamino)-2-(3-fluoro-5-methylphenyl)propan-2-ol
CID 79704574
2-(4-tert-butylphenyl)-1-(ethylamino)propan-2-ol
CID 62773195
2-(3-fluorophenyl)pent-4-en-2-ol
CID 22086786
1-(3,5-difluorophenyl)-2-(3-fluorophenyl)propan-2-ol
CID 105402440
2-(3-fluorophenyl)-4-methylheptan-2-ol
CID 65145180
2-(2-chloro-5-fluorophenyl)-1-(ethylamino)propan-2-ol
CID 105396212
1-bromo-1-(3-fluorophenyl)ethanol
CID 143635660
1-[(2,4-difluorophenyl)methylamino]-2-phenylpropan-2-ol
CID 62374509
4-(ethylamino)-3,3-difluoro-2-(4-fluorophenyl)butan-2-ol
CID 163265601

Frequently Asked Questions

What is the IUPAC name of 1-(ethylamino)-2-(3-fluorophenyl)propan-2-ol?
The IUPAC name of 1-(ethylamino)-2-(3-fluorophenyl)propan-2-ol (CID 62775143) is 1-(ethylamino)-2-(3-fluorophenyl)propan-2-ol.
What is the SMILES notation for 1-(ethylamino)-2-(3-fluorophenyl)propan-2-ol?
The canonical SMILES for 1-(ethylamino)-2-(3-fluorophenyl)propan-2-ol is CCNCC(C)(O)c1cccc(F)c1.
What is the InChIKey of 1-(ethylamino)-2-(3-fluorophenyl)propan-2-ol?
The InChIKey is DIRKXKDGRIJQBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16FNO/c1-3-13-8-11(2,14)9-5-4-6-10(12)7-9/h4-7,13-14H,3,8H2,1-2H3.
What are the key properties of 1-(ethylamino)-2-(3-fluorophenyl)propan-2-ol?
1-(ethylamino)-2-(3-fluorophenyl)propan-2-ol has a molecular weight of 197.25 g/mol, XLogP of 1.64, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(ethylamino)-2-(3-fluorophenyl)propan-2-ol is sourced from PubChem (CID 62775143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).