(1,2-difluorocyclopentyl)methanamine

C6H11F2N — CID 84762418

IUPAC(1,2-difluorocyclopentyl)methanamine
SMILESNCC1(F)CCCC1F
InChIInChI=1S/C6H11F2N/c7-5-2-1-3-6(5,8)4-9/h5H,1-4,9H2
InChIKeyYMJLZVCWCBHQTQ-UHFFFAOYSA-N
MW135.16 g/mol
LogP1.18
Rot. Bonds1

About (1,2-difluorocyclopentyl)methanamine

(1,2-difluorocyclopentyl)methanamine (PubChem CID 84762418) has the molecular formula C6H11F2N and a molecular weight of 135.16 g/mol. Its IUPAC name is (1,2-difluorocyclopentyl)methanamine.

Molecular Properties

Compound Name(1,2-difluorocyclopentyl)methanamine
PubChem CID84762418
Molecular FormulaC6H11F2N
Molecular Weight135.16 g/mol
Exact Mass135.09
IUPAC Name(1,2-difluorocyclopentyl)methanamine
SMILESNCC1(F)CCCC1F
InChIInChI=1S/C6H11F2N/c7-5-2-1-3-6(5,8)4-9/h5H,1-4,9H2
InChIKeyYMJLZVCWCBHQTQ-UHFFFAOYSA-N
XLogP1.18
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.16
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (1,2-difluorocyclopentyl)methanamine?
The IUPAC name of (1,2-difluorocyclopentyl)methanamine (CID 84762418) is (1,2-difluorocyclopentyl)methanamine.
What is the SMILES notation for (1,2-difluorocyclopentyl)methanamine?
The canonical SMILES for (1,2-difluorocyclopentyl)methanamine is NCC1(F)CCCC1F.
What is the InChIKey of (1,2-difluorocyclopentyl)methanamine?
The InChIKey is YMJLZVCWCBHQTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11F2N/c7-5-2-1-3-6(5,8)4-9/h5H,1-4,9H2.
What are the key properties of (1,2-difluorocyclopentyl)methanamine?
(1,2-difluorocyclopentyl)methanamine has a molecular weight of 135.16 g/mol, XLogP of 1.18, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1,2-difluorocyclopentyl)methanamine is sourced from PubChem (CID 84762418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).