2-cyclopentyl-2-(difluoromethoxy)-N-methylethanamine

C9H17F2NO — CID 84720006

IUPAC2-cyclopentyl-2-(difluoromethoxy)-N-methylethanamine
SMILESCNCC(OC(F)F)C1CCCC1
InChIInChI=1S/C9H17F2NO/c1-12-6-8(13-9(10)11)7-4-2-3-5-7/h7-9,12H,2-6H2,1H3
InChIKeyNIYWJAXZLZMYCQ-UHFFFAOYSA-N
MW193.24 g/mol
LogP2.00
Rot. Bonds5

About 2-cyclopentyl-2-(difluoromethoxy)-N-methylethanamine

2-cyclopentyl-2-(difluoromethoxy)-N-methylethanamine (PubChem CID 84720006) has the molecular formula C9H17F2NO and a molecular weight of 193.24 g/mol. Its IUPAC name is 2-cyclopentyl-2-(difluoromethoxy)-N-methylethanamine.

Molecular Properties

Compound Name2-cyclopentyl-2-(difluoromethoxy)-N-methylethanamine
PubChem CID84720006
Molecular FormulaC9H17F2NO
Molecular Weight193.24 g/mol
Exact Mass193.13
IUPAC Name2-cyclopentyl-2-(difluoromethoxy)-N-methylethanamine
SMILESCNCC(OC(F)F)C1CCCC1
InChIInChI=1S/C9H17F2NO/c1-12-6-8(13-9(10)11)7-4-2-3-5-7/h7-9,12H,2-6H2,1H3
InChIKeyNIYWJAXZLZMYCQ-UHFFFAOYSA-N
XLogP2.00
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.24
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 73994595
2-(1,2,2,3,3,4,4,5,5-Nonafluorocyclopentyl)morpholine
CID 19805676
N-butyl-5,5-difluoro-6-methoxy-4,7-dimethyloctan-1-amine
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2-cyclopentyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]ethanamine
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N-methyl-1-[1-(2,2,2-trifluoroethoxy)cyclopentyl]methanamine
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N-[[1-(2,2,2-trifluoroethoxy)cyclopentyl]methyl]ethanamine
CID 62111088
N-[[1-(2,2,2-trifluoroethoxy)cyclopentyl]methyl]propan-1-amine
CID 62111089
2-(2-ethylhexoxy)-N-(2,2,2-trifluoroethyl)propan-1-amine
CID 62598118
N-(2-cyclopentyloxyethyl)-4-(trifluoromethyl)cyclohexan-1-amine
CID 64755287
N-(2-cyclopentyloxyethyl)-2-(trifluoromethyl)cyclohexan-1-amine
CID 64757880
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1-cyclopentyl-N-[2-(trifluoromethoxy)ethyl]ethanamine
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Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-2-(difluoromethoxy)-N-methylethanamine?
The IUPAC name of 2-cyclopentyl-2-(difluoromethoxy)-N-methylethanamine (CID 84720006) is 2-cyclopentyl-2-(difluoromethoxy)-N-methylethanamine.
What is the SMILES notation for 2-cyclopentyl-2-(difluoromethoxy)-N-methylethanamine?
The canonical SMILES for 2-cyclopentyl-2-(difluoromethoxy)-N-methylethanamine is CNCC(OC(F)F)C1CCCC1.
What is the InChIKey of 2-cyclopentyl-2-(difluoromethoxy)-N-methylethanamine?
The InChIKey is NIYWJAXZLZMYCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17F2NO/c1-12-6-8(13-9(10)11)7-4-2-3-5-7/h7-9,12H,2-6H2,1H3.
What are the key properties of 2-cyclopentyl-2-(difluoromethoxy)-N-methylethanamine?
2-cyclopentyl-2-(difluoromethoxy)-N-methylethanamine has a molecular weight of 193.24 g/mol, XLogP of 2.00, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-2-(difluoromethoxy)-N-methylethanamine is sourced from PubChem (CID 84720006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).