2-[2-(1-aminocyclopropyl)ethyl]-5-fluorophenol

C11H14FNO — CID 105448984

IUPAC2-[2-(1-aminocyclopropyl)ethyl]-5-fluorophenol
SMILESNC1(CCc2ccc(F)cc2O)CC1
InChIInChI=1S/C11H14FNO/c12-9-2-1-8(10(14)7-9)3-4-11(13)5-6-11/h1-2,7,14H,3-6,13H2
InChIKeyKBTUVJZGXSIXIC-UHFFFAOYSA-N
MW195.24 g/mol
LogP1.96
Rot. Bonds3

About 2-[2-(1-aminocyclopropyl)ethyl]-5-fluorophenol

2-[2-(1-aminocyclopropyl)ethyl]-5-fluorophenol (PubChem CID 105448984) has the molecular formula C11H14FNO and a molecular weight of 195.24 g/mol. Its IUPAC name is 2-[2-(1-aminocyclopropyl)ethyl]-5-fluorophenol.

Molecular Properties

Compound Name2-[2-(1-aminocyclopropyl)ethyl]-5-fluorophenol
PubChem CID105448984
Molecular FormulaC11H14FNO
Molecular Weight195.24 g/mol
Exact Mass195.11
IUPAC Name2-[2-(1-aminocyclopropyl)ethyl]-5-fluorophenol
SMILESNC1(CCc2ccc(F)cc2O)CC1
InChIInChI=1S/C11H14FNO/c12-9-2-1-8(10(14)7-9)3-4-11(13)5-6-11/h1-2,7,14H,3-6,13H2
InChIKeyKBTUVJZGXSIXIC-UHFFFAOYSA-N
XLogP1.96
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.24
LogP ≤ 51.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-[2-(1-aminocyclopropyl)ethyl]-5-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-[2-(1-aminocyclopropyl)ethyl]-4-fluoro-6-methylphenol
CID 105463029
5-[2-(1-aminocyclopropyl)ethyl]-4-fluoro-2-methylphenol
CID 105463039
1-[2-(4-fluorophenyl)ethyl]cyclopropan-1-amine
CID 67420694
6-[2-(1-aminocyclopropyl)ethyl]-2,3-dihydro-1H-inden-5-ol
CID 105471605
4-[2-(1-aminocyclopropyl)ethyl]-2-fluoro-6-methylbenzene-1,3-diol
CID 105482966
2-[2-(1-aminocyclopropyl)ethyl]-4,5-dimethoxyphenol
CID 105499062
ethane;5-fluoro-2-propylphenol
CID 143012210
2-[(1-aminocyclopropyl)methyl]-5-(trifluoromethyl)phenol
CID 117333690
1-[2-(5-fluoro-1-benzothiophen-2-yl)ethyl]cyclopropan-1-amine
CID 105496556
3-(4-fluoro-2-hydroxyphenyl)propanal
CID 117276586
1-[2-(2-fluoro-4,5-dimethylphenyl)ethyl]cyclopropan-1-amine
CID 105460909
2-[2-(1-aminocyclopropyl)ethyl]-4-ethyl-5-methoxyphenol
CID 105496630

Frequently Asked Questions

What is the IUPAC name of 2-[2-(1-aminocyclopropyl)ethyl]-5-fluorophenol?
The IUPAC name of 2-[2-(1-aminocyclopropyl)ethyl]-5-fluorophenol (CID 105448984) is 2-[2-(1-aminocyclopropyl)ethyl]-5-fluorophenol.
What is the SMILES notation for 2-[2-(1-aminocyclopropyl)ethyl]-5-fluorophenol?
The canonical SMILES for 2-[2-(1-aminocyclopropyl)ethyl]-5-fluorophenol is NC1(CCc2ccc(F)cc2O)CC1.
What is the InChIKey of 2-[2-(1-aminocyclopropyl)ethyl]-5-fluorophenol?
The InChIKey is KBTUVJZGXSIXIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14FNO/c12-9-2-1-8(10(14)7-9)3-4-11(13)5-6-11/h1-2,7,14H,3-6,13H2.
What are the key properties of 2-[2-(1-aminocyclopropyl)ethyl]-5-fluorophenol?
2-[2-(1-aminocyclopropyl)ethyl]-5-fluorophenol has a molecular weight of 195.24 g/mol, XLogP of 1.96, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(1-aminocyclopropyl)ethyl]-5-fluorophenol is sourced from PubChem (CID 105448984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).