3-cyclopropyl-2,2-difluoropropan-1-amine

C6H11F2N — CID 23000189

IUPAC3-cyclopropyl-2,2-difluoropropan-1-amine
SMILESNCC(F)(F)CC1CC1
InChIInChI=1S/C6H11F2N/c7-6(8,4-9)3-5-1-2-5/h5H,1-4,9H2
InChIKeyJHSOCIXCZBVBSU-UHFFFAOYSA-N
MW135.16 g/mol
LogP1.38
Rot. Bonds3

About 3-cyclopropyl-2,2-difluoropropan-1-amine

3-cyclopropyl-2,2-difluoropropan-1-amine (PubChem CID 23000189) has the molecular formula C6H11F2N and a molecular weight of 135.16 g/mol. Its IUPAC name is 3-cyclopropyl-2,2-difluoropropan-1-amine.

Molecular Properties

Compound Name3-cyclopropyl-2,2-difluoropropan-1-amine
PubChem CID23000189
Molecular FormulaC6H11F2N
Molecular Weight135.16 g/mol
Exact Mass135.09
IUPAC Name3-cyclopropyl-2,2-difluoropropan-1-amine
SMILESNCC(F)(F)CC1CC1
InChIInChI=1S/C6H11F2N/c7-6(8,4-9)3-5-1-2-5/h5H,1-4,9H2
InChIKeyJHSOCIXCZBVBSU-UHFFFAOYSA-N
XLogP1.38
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.16
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-2,2-difluoropropan-1-amine?
The IUPAC name of 3-cyclopropyl-2,2-difluoropropan-1-amine (CID 23000189) is 3-cyclopropyl-2,2-difluoropropan-1-amine.
What is the SMILES notation for 3-cyclopropyl-2,2-difluoropropan-1-amine?
The canonical SMILES for 3-cyclopropyl-2,2-difluoropropan-1-amine is NCC(F)(F)CC1CC1.
What is the InChIKey of 3-cyclopropyl-2,2-difluoropropan-1-amine?
The InChIKey is JHSOCIXCZBVBSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11F2N/c7-6(8,4-9)3-5-1-2-5/h5H,1-4,9H2.
What are the key properties of 3-cyclopropyl-2,2-difluoropropan-1-amine?
3-cyclopropyl-2,2-difluoropropan-1-amine has a molecular weight of 135.16 g/mol, XLogP of 1.38, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-2,2-difluoropropan-1-amine is sourced from PubChem (CID 23000189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).