[(1R,2R)-2-(4-fluorophenyl)cyclopropyl]methanamine

C10H12FN — CID 68928221

IUPAC[(1R,2R)-2-(4-fluorophenyl)cyclopropyl]methanamine
SMILESNC[C@@H]1C[C@H]1c1ccc(F)cc1
InChIInChI=1S/C10H12FN/c11-9-3-1-7(2-4-9)10-5-8(10)6-12/h1-4,8,10H,5-6,12H2/t8-,10-/m0/s1
InChIKeySXEBSKUYTZWGJC-WPRPVWTQSA-N
MW165.21 g/mol
LogP1.89
Rot. Bonds2

About [(1R,2R)-2-(4-fluorophenyl)cyclopropyl]methanamine

[(1R,2R)-2-(4-fluorophenyl)cyclopropyl]methanamine (PubChem CID 68928221) has the molecular formula C10H12FN and a molecular weight of 165.21 g/mol. Its IUPAC name is [(1R,2R)-2-(4-fluorophenyl)cyclopropyl]methanamine.

Molecular Properties

Compound Name[(1R,2R)-2-(4-fluorophenyl)cyclopropyl]methanamine
PubChem CID68928221
Molecular FormulaC10H12FN
Molecular Weight165.21 g/mol
Exact Mass165.10
IUPAC Name[(1R,2R)-2-(4-fluorophenyl)cyclopropyl]methanamine
SMILESNC[C@@H]1C[C@H]1c1ccc(F)cc1
InChIInChI=1S/C10H12FN/c11-9-3-1-7(2-4-9)10-5-8(10)6-12/h1-4,8,10H,5-6,12H2/t8-,10-/m0/s1
InChIKeySXEBSKUYTZWGJC-WPRPVWTQSA-N
XLogP1.89
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.21
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of [(1R,2R)-2-(4-fluorophenyl)cyclopropyl]methanamine?
The IUPAC name of [(1R,2R)-2-(4-fluorophenyl)cyclopropyl]methanamine (CID 68928221) is [(1R,2R)-2-(4-fluorophenyl)cyclopropyl]methanamine.
What is the SMILES notation for [(1R,2R)-2-(4-fluorophenyl)cyclopropyl]methanamine?
The canonical SMILES for [(1R,2R)-2-(4-fluorophenyl)cyclopropyl]methanamine is NC[C@@H]1C[C@H]1c1ccc(F)cc1.
What is the InChIKey of [(1R,2R)-2-(4-fluorophenyl)cyclopropyl]methanamine?
The InChIKey is SXEBSKUYTZWGJC-WPRPVWTQSA-N. The full InChI is InChI=1S/C10H12FN/c11-9-3-1-7(2-4-9)10-5-8(10)6-12/h1-4,8,10H,5-6,12H2/t8-,10-/m0/s1.
What are the key properties of [(1R,2R)-2-(4-fluorophenyl)cyclopropyl]methanamine?
[(1R,2R)-2-(4-fluorophenyl)cyclopropyl]methanamine has a molecular weight of 165.21 g/mol, XLogP of 1.89, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R,2R)-2-(4-fluorophenyl)cyclopropyl]methanamine is sourced from PubChem (CID 68928221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).