3,3-difluoro-1-methylcyclopentan-1-amine

C6H11F2N — CID 84762419

IUPAC3,3-difluoro-1-methylcyclopentan-1-amine
SMILESCC1(N)CCC(F)(F)C1
InChIInChI=1S/C6H11F2N/c1-5(9)2-3-6(7,8)4-5/h2-4,9H2,1H3
InChIKeyKDRXWGKMPVQOAB-UHFFFAOYSA-N
MW135.16 g/mol
LogP1.52
Rot. Bonds

About 3,3-difluoro-1-methylcyclopentan-1-amine

3,3-difluoro-1-methylcyclopentan-1-amine (PubChem CID 84762419) has the molecular formula C6H11F2N and a molecular weight of 135.16 g/mol. Its IUPAC name is 3,3-difluoro-1-methylcyclopentan-1-amine.

Molecular Properties

Compound Name3,3-difluoro-1-methylcyclopentan-1-amine
PubChem CID84762419
Molecular FormulaC6H11F2N
Molecular Weight135.16 g/mol
Exact Mass135.09
IUPAC Name3,3-difluoro-1-methylcyclopentan-1-amine
SMILESCC1(N)CCC(F)(F)C1
InChIInChI=1S/C6H11F2N/c1-5(9)2-3-6(7,8)4-5/h2-4,9H2,1H3
InChIKeyKDRXWGKMPVQOAB-UHFFFAOYSA-N
XLogP1.52
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.16
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3,3-difluoro-1-methylcyclopentan-1-amine?
The IUPAC name of 3,3-difluoro-1-methylcyclopentan-1-amine (CID 84762419) is 3,3-difluoro-1-methylcyclopentan-1-amine.
What is the SMILES notation for 3,3-difluoro-1-methylcyclopentan-1-amine?
The canonical SMILES for 3,3-difluoro-1-methylcyclopentan-1-amine is CC1(N)CCC(F)(F)C1.
What is the InChIKey of 3,3-difluoro-1-methylcyclopentan-1-amine?
The InChIKey is KDRXWGKMPVQOAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11F2N/c1-5(9)2-3-6(7,8)4-5/h2-4,9H2,1H3.
What are the key properties of 3,3-difluoro-1-methylcyclopentan-1-amine?
3,3-difluoro-1-methylcyclopentan-1-amine has a molecular weight of 135.16 g/mol, XLogP of 1.52, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-difluoro-1-methylcyclopentan-1-amine is sourced from PubChem (CID 84762419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).