2,2-difluoro-1-methylcyclopentan-1-amine

C6H11F2N — CID 105427844

IUPAC2,2-difluoro-1-methylcyclopentan-1-amine
SMILESCC1(N)CCCC1(F)F
InChIInChI=1S/C6H11F2N/c1-5(9)3-2-4-6(5,7)8/h2-4,9H2,1H3
InChIKeyHKEHQKFSSKKGAX-UHFFFAOYSA-N
MW135.16 g/mol
LogP1.52
Rot. Bonds

About 2,2-difluoro-1-methylcyclopentan-1-amine

2,2-difluoro-1-methylcyclopentan-1-amine (PubChem CID 105427844) has the molecular formula C6H11F2N and a molecular weight of 135.16 g/mol. Its IUPAC name is 2,2-difluoro-1-methylcyclopentan-1-amine.

Molecular Properties

Compound Name2,2-difluoro-1-methylcyclopentan-1-amine
PubChem CID105427844
Molecular FormulaC6H11F2N
Molecular Weight135.16 g/mol
Exact Mass135.09
IUPAC Name2,2-difluoro-1-methylcyclopentan-1-amine
SMILESCC1(N)CCCC1(F)F
InChIInChI=1S/C6H11F2N/c1-5(9)3-2-4-6(5,7)8/h2-4,9H2,1H3
InChIKeyHKEHQKFSSKKGAX-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 2,2-difluoro-1-methylcyclopentan-1-amine?
The IUPAC name of 2,2-difluoro-1-methylcyclopentan-1-amine (CID 105427844) is 2,2-difluoro-1-methylcyclopentan-1-amine.
What is the SMILES notation for 2,2-difluoro-1-methylcyclopentan-1-amine?
The canonical SMILES for 2,2-difluoro-1-methylcyclopentan-1-amine is CC1(N)CCCC1(F)F.
What is the InChIKey of 2,2-difluoro-1-methylcyclopentan-1-amine?
The InChIKey is HKEHQKFSSKKGAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11F2N/c1-5(9)3-2-4-6(5,7)8/h2-4,9H2,1H3.
What are the key properties of 2,2-difluoro-1-methylcyclopentan-1-amine?
2,2-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 2,2-difluoro-1-methylcyclopentan-1-amine is sourced from PubChem (CID 105427844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).