[1-(4-fluorophenoxy)cyclopropyl]methanamine

C10H12FNO — CID 83920748

IUPAC[1-(4-fluorophenoxy)cyclopropyl]methanamine
SMILESNCC1(Oc2ccc(F)cc2)CC1
InChIInChI=1S/C10H12FNO/c11-8-1-3-9(4-2-8)13-10(7-12)5-6-10/h1-4H,5-7,12H2
InChIKeyGAGCSQXINHTWDV-UHFFFAOYSA-N
MW181.21 g/mol
LogP1.70
Rot. Bonds3

About [1-(4-fluorophenoxy)cyclopropyl]methanamine

[1-(4-fluorophenoxy)cyclopropyl]methanamine (PubChem CID 83920748) has the molecular formula C10H12FNO and a molecular weight of 181.21 g/mol. Its IUPAC name is [1-(4-fluorophenoxy)cyclopropyl]methanamine.

Molecular Properties

Compound Name[1-(4-fluorophenoxy)cyclopropyl]methanamine
PubChem CID83920748
Molecular FormulaC10H12FNO
Molecular Weight181.21 g/mol
Exact Mass181.09
IUPAC Name[1-(4-fluorophenoxy)cyclopropyl]methanamine
SMILESNCC1(Oc2ccc(F)cc2)CC1
InChIInChI=1S/C10H12FNO/c11-8-1-3-9(4-2-8)13-10(7-12)5-6-10/h1-4H,5-7,12H2
InChIKeyGAGCSQXINHTWDV-UHFFFAOYSA-N
XLogP1.70
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.21
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [1-(4-fluorophenoxy)cyclopropyl]methanamine?
The IUPAC name of [1-(4-fluorophenoxy)cyclopropyl]methanamine (CID 83920748) is [1-(4-fluorophenoxy)cyclopropyl]methanamine.
What is the SMILES notation for [1-(4-fluorophenoxy)cyclopropyl]methanamine?
The canonical SMILES for [1-(4-fluorophenoxy)cyclopropyl]methanamine is NCC1(Oc2ccc(F)cc2)CC1.
What is the InChIKey of [1-(4-fluorophenoxy)cyclopropyl]methanamine?
The InChIKey is GAGCSQXINHTWDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12FNO/c11-8-1-3-9(4-2-8)13-10(7-12)5-6-10/h1-4H,5-7,12H2.
What are the key properties of [1-(4-fluorophenoxy)cyclopropyl]methanamine?
[1-(4-fluorophenoxy)cyclopropyl]methanamine has a molecular weight of 181.21 g/mol, XLogP of 1.70, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-fluorophenoxy)cyclopropyl]methanamine is sourced from PubChem (CID 83920748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).