[1-(difluoromethoxymethyl)cyclopropyl]methanamine

C6H11F2NO — CID 84716435

IUPAC[1-(difluoromethoxymethyl)cyclopropyl]methanamine
SMILESNCC1(COC(F)F)CC1
InChIInChI=1S/C6H11F2NO/c7-5(8)10-4-6(3-9)1-2-6/h5H,1-4,9H2
InChIKeyJKVJUDQMZRXCAZ-UHFFFAOYSA-N
MW151.16 g/mol
LogP0.96
Rot. Bonds4

About [1-(difluoromethoxymethyl)cyclopropyl]methanamine

[1-(difluoromethoxymethyl)cyclopropyl]methanamine (PubChem CID 84716435) has the molecular formula C6H11F2NO and a molecular weight of 151.16 g/mol. Its IUPAC name is [1-(difluoromethoxymethyl)cyclopropyl]methanamine.

Molecular Properties

Compound Name[1-(difluoromethoxymethyl)cyclopropyl]methanamine
PubChem CID84716435
Molecular FormulaC6H11F2NO
Molecular Weight151.16 g/mol
Exact Mass151.08
IUPAC Name[1-(difluoromethoxymethyl)cyclopropyl]methanamine
SMILESNCC1(COC(F)F)CC1
InChIInChI=1S/C6H11F2NO/c7-5(8)10-4-6(3-9)1-2-6/h5H,1-4,9H2
InChIKeyJKVJUDQMZRXCAZ-UHFFFAOYSA-N
XLogP0.96
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.16
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [1-(difluoromethoxymethyl)cyclopropyl]methanamine?
The IUPAC name of [1-(difluoromethoxymethyl)cyclopropyl]methanamine (CID 84716435) is [1-(difluoromethoxymethyl)cyclopropyl]methanamine.
What is the SMILES notation for [1-(difluoromethoxymethyl)cyclopropyl]methanamine?
The canonical SMILES for [1-(difluoromethoxymethyl)cyclopropyl]methanamine is NCC1(COC(F)F)CC1.
What is the InChIKey of [1-(difluoromethoxymethyl)cyclopropyl]methanamine?
The InChIKey is JKVJUDQMZRXCAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11F2NO/c7-5(8)10-4-6(3-9)1-2-6/h5H,1-4,9H2.
What are the key properties of [1-(difluoromethoxymethyl)cyclopropyl]methanamine?
[1-(difluoromethoxymethyl)cyclopropyl]methanamine has a molecular weight of 151.16 g/mol, XLogP of 0.96, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(difluoromethoxymethyl)cyclopropyl]methanamine is sourced from PubChem (CID 84716435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).