1-[amino-(4-fluorophenyl)methyl]cyclopentan-1-ol

C12H16FNO — CID 121281031

IUPAC1-[amino-(4-fluorophenyl)methyl]cyclopentan-1-ol
SMILESNC(c1ccc(F)cc1)C1(O)CCCC1
InChIInChI=1S/C12H16FNO/c13-10-5-3-9(4-6-10)11(14)12(15)7-1-2-8-12/h3-6,11,15H,1-2,7-8,14H2
InChIKeyOONAZUNPNRGEQM-UHFFFAOYSA-N
MW209.26 g/mol
LogP2.13
Rot. Bonds2

About 1-[amino-(4-fluorophenyl)methyl]cyclopentan-1-ol

1-[amino-(4-fluorophenyl)methyl]cyclopentan-1-ol (PubChem CID 121281031) has the molecular formula C12H16FNO and a molecular weight of 209.26 g/mol. Its IUPAC name is 1-[amino-(4-fluorophenyl)methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name1-[amino-(4-fluorophenyl)methyl]cyclopentan-1-ol
PubChem CID121281031
Molecular FormulaC12H16FNO
Molecular Weight209.26 g/mol
Exact Mass209.12
IUPAC Name1-[amino-(4-fluorophenyl)methyl]cyclopentan-1-ol
SMILESNC(c1ccc(F)cc1)C1(O)CCCC1
InChIInChI=1S/C12H16FNO/c13-10-5-3-9(4-6-10)11(14)12(15)7-1-2-8-12/h3-6,11,15H,1-2,7-8,14H2
InChIKeyOONAZUNPNRGEQM-UHFFFAOYSA-N
XLogP2.13
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.26
LogP ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[amino-(4-fluorophenyl)methyl]cyclopentan-1-ol?
The IUPAC name of 1-[amino-(4-fluorophenyl)methyl]cyclopentan-1-ol (CID 121281031) is 1-[amino-(4-fluorophenyl)methyl]cyclopentan-1-ol.
What is the SMILES notation for 1-[amino-(4-fluorophenyl)methyl]cyclopentan-1-ol?
The canonical SMILES for 1-[amino-(4-fluorophenyl)methyl]cyclopentan-1-ol is NC(c1ccc(F)cc1)C1(O)CCCC1.
What is the InChIKey of 1-[amino-(4-fluorophenyl)methyl]cyclopentan-1-ol?
The InChIKey is OONAZUNPNRGEQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16FNO/c13-10-5-3-9(4-6-10)11(14)12(15)7-1-2-8-12/h3-6,11,15H,1-2,7-8,14H2.
What are the key properties of 1-[amino-(4-fluorophenyl)methyl]cyclopentan-1-ol?
1-[amino-(4-fluorophenyl)methyl]cyclopentan-1-ol has a molecular weight of 209.26 g/mol, XLogP of 2.13, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[amino-(4-fluorophenyl)methyl]cyclopentan-1-ol is sourced from PubChem (CID 121281031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).