2-(5-fluoro-2-propoxyanilino)ethanol

C11H16FNO2 — CID 167924183

IUPAC2-(5-fluoro-2-propoxyanilino)ethanol
SMILESCCCOc1ccc(F)cc1NCCO
InChIInChI=1S/C11H16FNO2/c1-2-7-15-11-4-3-9(12)8-10(11)13-5-6-14/h3-4,8,13-14H,2,5-7H2,1H3
InChIKeyXHXKTTXIHHBPIP-UHFFFAOYSA-N
MW213.25 g/mol
LogP2.02
Rot. Bonds6

About 2-(5-fluoro-2-propoxyanilino)ethanol

2-(5-fluoro-2-propoxyanilino)ethanol (PubChem CID 167924183) has the molecular formula C11H16FNO2 and a molecular weight of 213.25 g/mol. Its IUPAC name is 2-(5-fluoro-2-propoxyanilino)ethanol.

Molecular Properties

Compound Name2-(5-fluoro-2-propoxyanilino)ethanol
PubChem CID167924183
Molecular FormulaC11H16FNO2
Molecular Weight213.25 g/mol
Exact Mass213.12
IUPAC Name2-(5-fluoro-2-propoxyanilino)ethanol
SMILESCCCOc1ccc(F)cc1NCCO
InChIInChI=1S/C11H16FNO2/c1-2-7-15-11-4-3-9(12)8-10(11)13-5-6-14/h3-4,8,13-14H,2,5-7H2,1H3
InChIKeyXHXKTTXIHHBPIP-UHFFFAOYSA-N
XLogP2.02
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.25
LogP ≤ 52.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(5-fluoro-2-propoxyanilino)ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[5-amino-2-(2-methoxyethoxy)anilino]ethanol
CID 57176639
4-fluoro-1-methoxy-2-propoxybenzene
CID 126738516
CID 174591366
CID 174591366
2-(5-methyl-2-propoxyanilino)ethanethiol
CID 83961741
(Z)-4,4,4-trifluoro-3-(5-fluoro-2-propoxyanilino)but-2-enoic acid
CID 66917168
5-fluoro-2-propoxybenzenecarbothioamide
CID 63673082
2-bromo-N-[(5-bromo-2-propoxyphenyl)methyl]-5-fluoroaniline
CID 107632583
N-ethyl-2,5-dipropoxyaniline
CID 82267866
N-ethyl-N'-(5-fluoro-2-methoxyphenyl)ethane-1,2-diamine
CID 115205550
1-(5-fluoro-2-propoxyphenyl)propan-1-one
CID 82268324
N'-(5-methyl-2-propoxyphenyl)propane-1,3-diamine
CID 83961727
2-ethoxy-5-fluoro-N-methylaniline
CID 82268266

Frequently Asked Questions

What is the IUPAC name of 2-(5-fluoro-2-propoxyanilino)ethanol?
The IUPAC name of 2-(5-fluoro-2-propoxyanilino)ethanol (CID 167924183) is 2-(5-fluoro-2-propoxyanilino)ethanol.
What is the SMILES notation for 2-(5-fluoro-2-propoxyanilino)ethanol?
The canonical SMILES for 2-(5-fluoro-2-propoxyanilino)ethanol is CCCOc1ccc(F)cc1NCCO.
What is the InChIKey of 2-(5-fluoro-2-propoxyanilino)ethanol?
The InChIKey is XHXKTTXIHHBPIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16FNO2/c1-2-7-15-11-4-3-9(12)8-10(11)13-5-6-14/h3-4,8,13-14H,2,5-7H2,1H3.
What are the key properties of 2-(5-fluoro-2-propoxyanilino)ethanol?
2-(5-fluoro-2-propoxyanilino)ethanol has a molecular weight of 213.25 g/mol, XLogP of 2.02, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-fluoro-2-propoxyanilino)ethanol is sourced from PubChem (CID 167924183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).