1-[[[3-(2-fluorophenyl)cyclobutyl]amino]methyl]cyclopentan-1-ol

C16H22FNO — CID 65105161

IUPAC1-[[[3-(2-fluorophenyl)cyclobutyl]amino]methyl]cyclopentan-1-ol
SMILESOC1(CNC2CC(c3ccccc3F)C2)CCCC1
InChIInChI=1S/C16H22FNO/c17-15-6-2-1-5-14(15)12-9-13(10-12)18-11-16(19)7-3-4-8-16/h1-2,5-6,12-13,18-19H,3-4,7-11H2
InChIKeyQXFOHVGQHVYGIJ-UHFFFAOYSA-N
MW263.36 g/mol
LogP2.97
Rot. Bonds4

About 1-[[[3-(2-fluorophenyl)cyclobutyl]amino]methyl]cyclopentan-1-ol

1-[[[3-(2-fluorophenyl)cyclobutyl]amino]methyl]cyclopentan-1-ol (PubChem CID 65105161) has the molecular formula C16H22FNO and a molecular weight of 263.36 g/mol. Its IUPAC name is 1-[[[3-(2-fluorophenyl)cyclobutyl]amino]methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name1-[[[3-(2-fluorophenyl)cyclobutyl]amino]methyl]cyclopentan-1-ol
PubChem CID65105161
Molecular FormulaC16H22FNO
Molecular Weight263.36 g/mol
Exact Mass263.17
IUPAC Name1-[[[3-(2-fluorophenyl)cyclobutyl]amino]methyl]cyclopentan-1-ol
SMILESOC1(CNC2CC(c3ccccc3F)C2)CCCC1
InChIInChI=1S/C16H22FNO/c17-15-6-2-1-5-14(15)12-9-13(10-12)18-11-16(19)7-3-4-8-16/h1-2,5-6,12-13,18-19H,3-4,7-11H2
InChIKeyQXFOHVGQHVYGIJ-UHFFFAOYSA-N
XLogP2.97
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.36
LogP ≤ 52.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 1-[[[3-(2-fluorophenyl)cyclobutyl]amino]methyl]cyclopentan-1-ol 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 1-[[[3-(2-fluorophenyl)cyclobutyl]amino]methyl]cyclopentan-1-ol?
The IUPAC name of 1-[[[3-(2-fluorophenyl)cyclobutyl]amino]methyl]cyclopentan-1-ol (CID 65105161) is 1-[[[3-(2-fluorophenyl)cyclobutyl]amino]methyl]cyclopentan-1-ol.
What is the SMILES notation for 1-[[[3-(2-fluorophenyl)cyclobutyl]amino]methyl]cyclopentan-1-ol?
The canonical SMILES for 1-[[[3-(2-fluorophenyl)cyclobutyl]amino]methyl]cyclopentan-1-ol is OC1(CNC2CC(c3ccccc3F)C2)CCCC1.
What is the InChIKey of 1-[[[3-(2-fluorophenyl)cyclobutyl]amino]methyl]cyclopentan-1-ol?
The InChIKey is QXFOHVGQHVYGIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22FNO/c17-15-6-2-1-5-14(15)12-9-13(10-12)18-11-16(19)7-3-4-8-16/h1-2,5-6,12-13,18-19H,3-4,7-11H2.
What are the key properties of 1-[[[3-(2-fluorophenyl)cyclobutyl]amino]methyl]cyclopentan-1-ol?
1-[[[3-(2-fluorophenyl)cyclobutyl]amino]methyl]cyclopentan-1-ol has a molecular weight of 263.36 g/mol, XLogP of 2.97, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[[3-(2-fluorophenyl)cyclobutyl]amino]methyl]cyclopentan-1-ol is sourced from PubChem (CID 65105161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).