2-(2-fluorophenyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-5-amine

C13H12FN3 — CID 83861841

IUPAC2-(2-fluorophenyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-5-amine
SMILESNC1CCc2nc(-c3ccccc3F)ncc21
InChIInChI=1S/C13H12FN3/c14-10-4-2-1-3-8(10)13-16-7-9-11(15)5-6-12(9)17-13/h1-4,7,11H,5-6,15H2
InChIKeyWFOLPVICEWPROG-UHFFFAOYSA-N
MW229.26 g/mol
LogP2.23
Rot. Bonds1

About 2-(2-fluorophenyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-5-amine

2-(2-fluorophenyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-5-amine (PubChem CID 83861841) has the molecular formula C13H12FN3 and a molecular weight of 229.26 g/mol. Its IUPAC name is 2-(2-fluorophenyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-5-amine.

Molecular Properties

Compound Name2-(2-fluorophenyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-5-amine
PubChem CID83861841
Molecular FormulaC13H12FN3
Molecular Weight229.26 g/mol
Exact Mass229.10
IUPAC Name2-(2-fluorophenyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-5-amine
SMILESNC1CCc2nc(-c3ccccc3F)ncc21
InChIInChI=1S/C13H12FN3/c14-10-4-2-1-3-8(10)13-16-7-9-11(15)5-6-12(9)17-13/h1-4,7,11H,5-6,15H2
InChIKeyWFOLPVICEWPROG-UHFFFAOYSA-N
XLogP2.23
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.26
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-5-amine?
The IUPAC name of 2-(2-fluorophenyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-5-amine (CID 83861841) is 2-(2-fluorophenyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-5-amine.
What is the SMILES notation for 2-(2-fluorophenyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-5-amine?
The canonical SMILES for 2-(2-fluorophenyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-5-amine is NC1CCc2nc(-c3ccccc3F)ncc21.
What is the InChIKey of 2-(2-fluorophenyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-5-amine?
The InChIKey is WFOLPVICEWPROG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12FN3/c14-10-4-2-1-3-8(10)13-16-7-9-11(15)5-6-12(9)17-13/h1-4,7,11H,5-6,15H2.
What are the key properties of 2-(2-fluorophenyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-5-amine?
2-(2-fluorophenyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-5-amine has a molecular weight of 229.26 g/mol, XLogP of 2.23, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-5-amine is sourced from PubChem (CID 83861841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).