1-(2,2-difluoroethoxymethyl)cyclopentan-1-amine

C8H15F2NO — CID 64571818

IUPAC1-(2,2-difluoroethoxymethyl)cyclopentan-1-amine
SMILESNC1(COCC(F)F)CCCC1
InChIInChI=1S/C8H15F2NO/c9-7(10)5-12-6-8(11)3-1-2-4-8/h7H,1-6,11H2
InChIKeyRKBFSKCZDOQHLK-UHFFFAOYSA-N
MW179.21 g/mol
LogP1.54
Rot. Bonds4

About 1-(2,2-difluoroethoxymethyl)cyclopentan-1-amine

1-(2,2-difluoroethoxymethyl)cyclopentan-1-amine (PubChem CID 64571818) has the molecular formula C8H15F2NO and a molecular weight of 179.21 g/mol. Its IUPAC name is 1-(2,2-difluoroethoxymethyl)cyclopentan-1-amine.

Molecular Properties

Compound Name1-(2,2-difluoroethoxymethyl)cyclopentan-1-amine
PubChem CID64571818
Molecular FormulaC8H15F2NO
Molecular Weight179.21 g/mol
Exact Mass179.11
IUPAC Name1-(2,2-difluoroethoxymethyl)cyclopentan-1-amine
SMILESNC1(COCC(F)F)CCCC1
InChIInChI=1S/C8H15F2NO/c9-7(10)5-12-6-8(11)3-1-2-4-8/h7H,1-6,11H2
InChIKeyRKBFSKCZDOQHLK-UHFFFAOYSA-N
XLogP1.54
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.21
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[2-(2,2,2-Trifluoroethoxy)ethyl]cyclopentan-1-amine
CID 62621224
1-[3-(2,2,2-Trifluoroethoxy)propyl]cyclopentan-1-amine
CID 62621601
1-(3,3,3-Trifluoropropoxymethyl)cyclopentan-1-amine
CID 64565498
1-(3,3,3-Trifluoropropoxymethyl)cyclohexan-1-amine
CID 64565499
1-(2,2,2-Trifluoroethoxymethyl)cyclohexan-1-amine
CID 64571858
1-[2-(2,2,2-Trifluoroethoxy)ethoxymethyl]cyclopentan-1-amine
CID 64572036
1-(2,2,2-Trifluoroethoxymethyl)cyclopentan-1-amine
CID 64572665
1-[3-(2,2,2-Trifluoroethoxy)propoxymethyl]cyclopentan-1-amine
CID 64572668
1-(2,2-Difluoroethoxymethyl)cyclohexan-1-amine
CID 64574422
1-[2-(Trifluoromethoxy)ethoxymethyl]cyclopentan-1-amine
CID 65804570
1-(2-Fluoroethoxymethyl)cyclopentan-1-amine
CID 80694622
1-(3-Fluoropropoxymethyl)cyclopentan-1-amine
CID 81113044

Frequently Asked Questions

What is the IUPAC name of 1-(2,2-difluoroethoxymethyl)cyclopentan-1-amine?
The IUPAC name of 1-(2,2-difluoroethoxymethyl)cyclopentan-1-amine (CID 64571818) is 1-(2,2-difluoroethoxymethyl)cyclopentan-1-amine.
What is the SMILES notation for 1-(2,2-difluoroethoxymethyl)cyclopentan-1-amine?
The canonical SMILES for 1-(2,2-difluoroethoxymethyl)cyclopentan-1-amine is NC1(COCC(F)F)CCCC1.
What is the InChIKey of 1-(2,2-difluoroethoxymethyl)cyclopentan-1-amine?
The InChIKey is RKBFSKCZDOQHLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15F2NO/c9-7(10)5-12-6-8(11)3-1-2-4-8/h7H,1-6,11H2.
What are the key properties of 1-(2,2-difluoroethoxymethyl)cyclopentan-1-amine?
1-(2,2-difluoroethoxymethyl)cyclopentan-1-amine has a molecular weight of 179.21 g/mol, XLogP of 1.54, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2-difluoroethoxymethyl)cyclopentan-1-amine is sourced from PubChem (CID 64571818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).