1-(difluoromethoxymethyl)cyclopentan-1-amine

C7H13F2NO — CID 84717013

IUPAC1-(difluoromethoxymethyl)cyclopentan-1-amine
SMILESNC1(COC(F)F)CCCC1
InChIInChI=1S/C7H13F2NO/c8-6(9)11-5-7(10)3-1-2-4-7/h6H,1-5,10H2
InChIKeyREXOSTCPIXXLFS-UHFFFAOYSA-N
MW165.18 g/mol
LogP1.50
Rot. Bonds3

About 1-(difluoromethoxymethyl)cyclopentan-1-amine

1-(difluoromethoxymethyl)cyclopentan-1-amine (PubChem CID 84717013) has the molecular formula C7H13F2NO and a molecular weight of 165.18 g/mol. Its IUPAC name is 1-(difluoromethoxymethyl)cyclopentan-1-amine.

Molecular Properties

Compound Name1-(difluoromethoxymethyl)cyclopentan-1-amine
PubChem CID84717013
Molecular FormulaC7H13F2NO
Molecular Weight165.18 g/mol
Exact Mass165.10
IUPAC Name1-(difluoromethoxymethyl)cyclopentan-1-amine
SMILESNC1(COC(F)F)CCCC1
InChIInChI=1S/C7H13F2NO/c8-6(9)11-5-7(10)3-1-2-4-7/h6H,1-5,10H2
InChIKeyREXOSTCPIXXLFS-UHFFFAOYSA-N
XLogP1.50
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.18
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(difluoromethoxymethyl)cyclopentan-1-amine?
The IUPAC name of 1-(difluoromethoxymethyl)cyclopentan-1-amine (CID 84717013) is 1-(difluoromethoxymethyl)cyclopentan-1-amine.
What is the SMILES notation for 1-(difluoromethoxymethyl)cyclopentan-1-amine?
The canonical SMILES for 1-(difluoromethoxymethyl)cyclopentan-1-amine is NC1(COC(F)F)CCCC1.
What is the InChIKey of 1-(difluoromethoxymethyl)cyclopentan-1-amine?
The InChIKey is REXOSTCPIXXLFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13F2NO/c8-6(9)11-5-7(10)3-1-2-4-7/h6H,1-5,10H2.
What are the key properties of 1-(difluoromethoxymethyl)cyclopentan-1-amine?
1-(difluoromethoxymethyl)cyclopentan-1-amine has a molecular weight of 165.18 g/mol, XLogP of 1.50, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(difluoromethoxymethyl)cyclopentan-1-amine is sourced from PubChem (CID 84717013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).