1-(2,5-difluorophenyl)cyclopentan-1-amine

C11H13F2N — CID 62802401

IUPAC1-(2,5-difluorophenyl)cyclopentan-1-amine
SMILESNC1(c2cc(F)ccc2F)CCCC1
InChIInChI=1S/C11H13F2N/c12-8-3-4-10(13)9(7-8)11(14)5-1-2-6-11/h3-4,7H,1-2,5-6,14H2
InChIKeyYONVYINFQLCKJF-UHFFFAOYSA-N
MW197.23 g/mol
LogP2.69
Rot. Bonds1

About 1-(2,5-difluorophenyl)cyclopentan-1-amine

1-(2,5-difluorophenyl)cyclopentan-1-amine (PubChem CID 62802401) has the molecular formula C11H13F2N and a molecular weight of 197.23 g/mol. Its IUPAC name is 1-(2,5-difluorophenyl)cyclopentan-1-amine.

Molecular Properties

Compound Name1-(2,5-difluorophenyl)cyclopentan-1-amine
PubChem CID62802401
Molecular FormulaC11H13F2N
Molecular Weight197.23 g/mol
Exact Mass197.10
IUPAC Name1-(2,5-difluorophenyl)cyclopentan-1-amine
SMILESNC1(c2cc(F)ccc2F)CCCC1
InChIInChI=1S/C11H13F2N/c12-8-3-4-10(13)9(7-8)11(14)5-1-2-6-11/h3-4,7H,1-2,5-6,14H2
InChIKeyYONVYINFQLCKJF-UHFFFAOYSA-N
XLogP2.69
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.23
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(2,5-difluorophenyl)cyclopentan-1-amine?
The IUPAC name of 1-(2,5-difluorophenyl)cyclopentan-1-amine (CID 62802401) is 1-(2,5-difluorophenyl)cyclopentan-1-amine.
What is the SMILES notation for 1-(2,5-difluorophenyl)cyclopentan-1-amine?
The canonical SMILES for 1-(2,5-difluorophenyl)cyclopentan-1-amine is NC1(c2cc(F)ccc2F)CCCC1.
What is the InChIKey of 1-(2,5-difluorophenyl)cyclopentan-1-amine?
The InChIKey is YONVYINFQLCKJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13F2N/c12-8-3-4-10(13)9(7-8)11(14)5-1-2-6-11/h3-4,7H,1-2,5-6,14H2.
What are the key properties of 1-(2,5-difluorophenyl)cyclopentan-1-amine?
1-(2,5-difluorophenyl)cyclopentan-1-amine has a molecular weight of 197.23 g/mol, XLogP of 2.69, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-difluorophenyl)cyclopentan-1-amine is sourced from PubChem (CID 62802401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).