3-(3,5-difluorophenyl)-N-ethyl-2-methylcyclopentan-1-amine

C14H19F2N — CID 64908994

IUPAC3-(3,5-difluorophenyl)-N-ethyl-2-methylcyclopentan-1-amine
SMILESCCNC1CCC(c2cc(F)cc(F)c2)C1C
InChIInChI=1S/C14H19F2N/c1-3-17-14-5-4-13(9(14)2)10-6-11(15)8-12(16)7-10/h6-9,13-14,17H,3-5H2,1-2H3
InChIKeyFJGSKJXPEPCTLD-UHFFFAOYSA-N
MW239.31 g/mol
LogP3.46
Rot. Bonds3

About 3-(3,5-difluorophenyl)-N-ethyl-2-methylcyclopentan-1-amine

3-(3,5-difluorophenyl)-N-ethyl-2-methylcyclopentan-1-amine (PubChem CID 64908994) has the molecular formula C14H19F2N and a molecular weight of 239.31 g/mol. Its IUPAC name is 3-(3,5-difluorophenyl)-N-ethyl-2-methylcyclopentan-1-amine.

Molecular Properties

Compound Name3-(3,5-difluorophenyl)-N-ethyl-2-methylcyclopentan-1-amine
PubChem CID64908994
Molecular FormulaC14H19F2N
Molecular Weight239.31 g/mol
Exact Mass239.15
IUPAC Name3-(3,5-difluorophenyl)-N-ethyl-2-methylcyclopentan-1-amine
SMILESCCNC1CCC(c2cc(F)cc(F)c2)C1C
InChIInChI=1S/C14H19F2N/c1-3-17-14-5-4-13(9(14)2)10-6-11(15)8-12(16)7-10/h6-9,13-14,17H,3-5H2,1-2H3
InChIKeyFJGSKJXPEPCTLD-UHFFFAOYSA-N
XLogP3.46
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.31
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-(4-chlorophenyl)-N-ethyl-2-methylcyclopentan-1-amine
CID 64908122
3-(4-fluorophenyl)-2-methyl-N-propylcyclopentan-1-amine
CID 64909010
N-ethyl-2-methyl-3-(1-methylpyrazol-4-yl)cyclopentan-1-amine
CID 64909644
cis-(1S,2S)-2-(3,5-dimethylphenyl)-N-ethylcyclobutan-1-amine
CID 162470149
2-[(3,5-difluorophenyl)methyl]-N-ethyl-4-methylcyclohexan-1-amine
CID 105404538
3-(5-fluoro-3-pyridinyl)-N,2-dimethylcyclopentan-1-amine
CID 64907455
3-[3-fluoro-4-(trifluoromethyl)phenyl]-2-methyl-N-propylcyclopentan-1-amine
CID 107290266
3-(2,5-dimethoxyphenyl)-N-ethyl-2-methylcyclopentan-1-amine
CID 64907254
1-(3-chloro-2-methylcyclopentyl)-3-fluoro-5-methylbenzene
CID 79704770
1-(3-bromo-2-methylcyclopentyl)-3-fluoro-5-methylbenzene
CID 79704912
3-[(2-chloro-5-fluorophenyl)methyl]-N-ethyl-2-methylcyclopentan-1-amine
CID 102620493
3-(5-fluoro-1-benzofuran-2-yl)-2-methyl-N-propylcyclopentan-1-amine
CID 114733630

Frequently Asked Questions

What is the IUPAC name of 3-(3,5-difluorophenyl)-N-ethyl-2-methylcyclopentan-1-amine?
The IUPAC name of 3-(3,5-difluorophenyl)-N-ethyl-2-methylcyclopentan-1-amine (CID 64908994) is 3-(3,5-difluorophenyl)-N-ethyl-2-methylcyclopentan-1-amine.
What is the SMILES notation for 3-(3,5-difluorophenyl)-N-ethyl-2-methylcyclopentan-1-amine?
The canonical SMILES for 3-(3,5-difluorophenyl)-N-ethyl-2-methylcyclopentan-1-amine is CCNC1CCC(c2cc(F)cc(F)c2)C1C.
What is the InChIKey of 3-(3,5-difluorophenyl)-N-ethyl-2-methylcyclopentan-1-amine?
The InChIKey is FJGSKJXPEPCTLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19F2N/c1-3-17-14-5-4-13(9(14)2)10-6-11(15)8-12(16)7-10/h6-9,13-14,17H,3-5H2,1-2H3.
What are the key properties of 3-(3,5-difluorophenyl)-N-ethyl-2-methylcyclopentan-1-amine?
3-(3,5-difluorophenyl)-N-ethyl-2-methylcyclopentan-1-amine has a molecular weight of 239.31 g/mol, XLogP of 3.46, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,5-difluorophenyl)-N-ethyl-2-methylcyclopentan-1-amine is sourced from PubChem (CID 64908994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).