3-(3,5-difluorophenyl)cyclopentan-1-amine

C11H13F2N — CID 64503877

IUPAC3-(3,5-difluorophenyl)cyclopentan-1-amine
SMILESNC1CCC(c2cc(F)cc(F)c2)C1
InChIInChI=1S/C11H13F2N/c12-9-3-8(4-10(13)6-9)7-1-2-11(14)5-7/h3-4,6-7,11H,1-2,5,14H2
InChIKeyWNEOYUKQKHZQBW-UHFFFAOYSA-N
MW197.23 g/mol
LogP2.56
Rot. Bonds1

About 3-(3,5-difluorophenyl)cyclopentan-1-amine

3-(3,5-difluorophenyl)cyclopentan-1-amine (PubChem CID 64503877) has the molecular formula C11H13F2N and a molecular weight of 197.23 g/mol. Its IUPAC name is 3-(3,5-difluorophenyl)cyclopentan-1-amine.

Molecular Properties

Compound Name3-(3,5-difluorophenyl)cyclopentan-1-amine
PubChem CID64503877
Molecular FormulaC11H13F2N
Molecular Weight197.23 g/mol
Exact Mass197.10
IUPAC Name3-(3,5-difluorophenyl)cyclopentan-1-amine
SMILESNC1CCC(c2cc(F)cc(F)c2)C1
InChIInChI=1S/C11H13F2N/c12-9-3-8(4-10(13)6-9)7-1-2-11(14)5-7/h3-4,6-7,11H,1-2,5,14H2
InChIKeyWNEOYUKQKHZQBW-UHFFFAOYSA-N
XLogP2.56
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 ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-(3,5-difluorophenyl)cyclopentan-1-amine?
The IUPAC name of 3-(3,5-difluorophenyl)cyclopentan-1-amine (CID 64503877) is 3-(3,5-difluorophenyl)cyclopentan-1-amine.
What is the SMILES notation for 3-(3,5-difluorophenyl)cyclopentan-1-amine?
The canonical SMILES for 3-(3,5-difluorophenyl)cyclopentan-1-amine is NC1CCC(c2cc(F)cc(F)c2)C1.
What is the InChIKey of 3-(3,5-difluorophenyl)cyclopentan-1-amine?
The InChIKey is WNEOYUKQKHZQBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13F2N/c12-9-3-8(4-10(13)6-9)7-1-2-11(14)5-7/h3-4,6-7,11H,1-2,5,14H2.
What are the key properties of 3-(3,5-difluorophenyl)cyclopentan-1-amine?
3-(3,5-difluorophenyl)cyclopentan-1-amine has a molecular weight of 197.23 g/mol, XLogP of 2.56, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,5-difluorophenyl)cyclopentan-1-amine is sourced from PubChem (CID 64503877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).