4-[1-(cyclopropylamino)-2-hydroxyethyl]-2-fluorophenol

C11H14FNO2 — CID 107693474

IUPAC4-[1-(cyclopropylamino)-2-hydroxyethyl]-2-fluorophenol
SMILESOCC(NC1CC1)c1ccc(O)c(F)c1
InChIInChI=1S/C11H14FNO2/c12-9-5-7(1-4-11(9)15)10(6-14)13-8-2-3-8/h1,4-5,8,10,13-15H,2-3,6H2
InChIKeyYMLLDSCVUAARIZ-UHFFFAOYSA-N
MW211.24 g/mol
LogP1.32
Rot. Bonds4

About 4-[1-(cyclopropylamino)-2-hydroxyethyl]-2-fluorophenol

4-[1-(cyclopropylamino)-2-hydroxyethyl]-2-fluorophenol (PubChem CID 107693474) has the molecular formula C11H14FNO2 and a molecular weight of 211.24 g/mol. Its IUPAC name is 4-[1-(cyclopropylamino)-2-hydroxyethyl]-2-fluorophenol.

Molecular Properties

Compound Name4-[1-(cyclopropylamino)-2-hydroxyethyl]-2-fluorophenol
PubChem CID107693474
Molecular FormulaC11H14FNO2
Molecular Weight211.24 g/mol
Exact Mass211.10
IUPAC Name4-[1-(cyclopropylamino)-2-hydroxyethyl]-2-fluorophenol
SMILESOCC(NC1CC1)c1ccc(O)c(F)c1
InChIInChI=1S/C11H14FNO2/c12-9-5-7(1-4-11(9)15)10(6-14)13-8-2-3-8/h1,4-5,8,10,13-15H,2-3,6H2
InChIKeyYMLLDSCVUAARIZ-UHFFFAOYSA-N
XLogP1.32
TPSA52.49 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.24
LogP ≤ 51.32
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 4-[1-(cyclopropylamino)-2-hydroxyethyl]-2-fluorophenol 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-(cyclopropylamino)-2-(3-fluoro-4-methoxyphenyl)ethanol
CID 65101361
2-(cyclopropylamino)-2-(3-fluorophenyl)ethanol
CID 61055012
2-(cyclopropylamino)-2-[4-(difluoromethyl)phenyl]ethanol
CID 115525129
2-(3-chloro-4-fluorophenyl)-2-(cycloheptylamino)ethanol
CID 81165963
2-(cyclopropylamino)-2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol
CID 82289327
4-[(1S)-1-(cyclopentylamino)ethyl]-2-fluorophenol
CID 29038955
(2S)-2-(cyclopropylamino)-2-phenylethanol
CID 93471499
4-[1-(4-chloroanilino)-2-hydroxyethyl]-2-fluorophenol
CID 107693464
4-[1-(butan-2-ylamino)-2-hydroxyethyl]-2-fluorophenol
CID 107693456
4-[1-(cycloheptylamino)-2-hydroxyethyl]-2-ethoxyphenol
CID 61054148
methyl 2-(cyclopropylamino)-2-(3-fluoro-4-hydroxyphenyl)acetate
CID 107690174
2-(4-amino-3-chloro-5-fluorophenyl)-2-(cyclopropylamino)ethanol;hydrochloride
CID 141286037

Frequently Asked Questions

What is the IUPAC name of 4-[1-(cyclopropylamino)-2-hydroxyethyl]-2-fluorophenol?
The IUPAC name of 4-[1-(cyclopropylamino)-2-hydroxyethyl]-2-fluorophenol (CID 107693474) is 4-[1-(cyclopropylamino)-2-hydroxyethyl]-2-fluorophenol.
What is the SMILES notation for 4-[1-(cyclopropylamino)-2-hydroxyethyl]-2-fluorophenol?
The canonical SMILES for 4-[1-(cyclopropylamino)-2-hydroxyethyl]-2-fluorophenol is OCC(NC1CC1)c1ccc(O)c(F)c1.
What is the InChIKey of 4-[1-(cyclopropylamino)-2-hydroxyethyl]-2-fluorophenol?
The InChIKey is YMLLDSCVUAARIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14FNO2/c12-9-5-7(1-4-11(9)15)10(6-14)13-8-2-3-8/h1,4-5,8,10,13-15H,2-3,6H2.
What are the key properties of 4-[1-(cyclopropylamino)-2-hydroxyethyl]-2-fluorophenol?
4-[1-(cyclopropylamino)-2-hydroxyethyl]-2-fluorophenol has a molecular weight of 211.24 g/mol, XLogP of 1.32, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(cyclopropylamino)-2-hydroxyethyl]-2-fluorophenol is sourced from PubChem (CID 107693474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).