[5-(1-aminocyclopropyl)-2-fluorophenyl]methanol

C10H12FNO — CID 117278716

IUPAC[5-(1-aminocyclopropyl)-2-fluorophenyl]methanol
SMILESNC1(c2ccc(F)c(CO)c2)CC1
InChIInChI=1S/C10H12FNO/c11-9-2-1-8(5-7(9)6-13)10(12)3-4-10/h1-2,5,13H,3-4,6,12H2
InChIKeyWRIVWTMJEQKDOG-UHFFFAOYSA-N
MW181.21 g/mol
LogP1.27
Rot. Bonds2

About [5-(1-aminocyclopropyl)-2-fluorophenyl]methanol

[5-(1-aminocyclopropyl)-2-fluorophenyl]methanol (PubChem CID 117278716) has the molecular formula C10H12FNO and a molecular weight of 181.21 g/mol. Its IUPAC name is [5-(1-aminocyclopropyl)-2-fluorophenyl]methanol.

Molecular Properties

Compound Name[5-(1-aminocyclopropyl)-2-fluorophenyl]methanol
PubChem CID117278716
Molecular FormulaC10H12FNO
Molecular Weight181.21 g/mol
Exact Mass181.09
IUPAC Name[5-(1-aminocyclopropyl)-2-fluorophenyl]methanol
SMILESNC1(c2ccc(F)c(CO)c2)CC1
InChIInChI=1S/C10H12FNO/c11-9-2-1-8(5-7(9)6-13)10(12)3-4-10/h1-2,5,13H,3-4,6,12H2
InChIKeyWRIVWTMJEQKDOG-UHFFFAOYSA-N
XLogP1.27
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.21
LogP ≤ 51.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze [5-(1-aminocyclopropyl)-2-fluorophenyl]methanol with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [5-(1-aminocyclopropyl)-2-fluorophenyl]methanol?
The IUPAC name of [5-(1-aminocyclopropyl)-2-fluorophenyl]methanol (CID 117278716) is [5-(1-aminocyclopropyl)-2-fluorophenyl]methanol.
What is the SMILES notation for [5-(1-aminocyclopropyl)-2-fluorophenyl]methanol?
The canonical SMILES for [5-(1-aminocyclopropyl)-2-fluorophenyl]methanol is NC1(c2ccc(F)c(CO)c2)CC1.
What is the InChIKey of [5-(1-aminocyclopropyl)-2-fluorophenyl]methanol?
The InChIKey is WRIVWTMJEQKDOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12FNO/c11-9-2-1-8(5-7(9)6-13)10(12)3-4-10/h1-2,5,13H,3-4,6,12H2.
What are the key properties of [5-(1-aminocyclopropyl)-2-fluorophenyl]methanol?
[5-(1-aminocyclopropyl)-2-fluorophenyl]methanol has a molecular weight of 181.21 g/mol, XLogP of 1.27, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(1-aminocyclopropyl)-2-fluorophenyl]methanol is sourced from PubChem (CID 117278716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).