2,2-difluoropropan-1-amine;hydrochloride

C3H8ClF2N — CID 2758355

IUPAC2,2-difluoropropan-1-amine;hydrochloride
SMILESCC(F)(F)CN.Cl
InChIInChI=1S/C3H7F2N.ClH/c1-3(4,5)2-6;/h2,6H2,1H3;1H
InChIKeyIDJKGOWDPKVIBR-UHFFFAOYSA-N
MW131.55 g/mol
LogP1.02
Rot. Bonds1

About 2,2-difluoropropan-1-amine;hydrochloride

2,2-difluoropropan-1-amine;hydrochloride (PubChem CID 2758355) has the molecular formula C3H8ClF2N and a molecular weight of 131.55 g/mol. Its IUPAC name is 2,2-difluoropropan-1-amine;hydrochloride.

Molecular Properties

Compound Name2,2-difluoropropan-1-amine;hydrochloride
PubChem CID2758355
Molecular FormulaC3H8ClF2N
Molecular Weight131.55 g/mol
Exact Mass131.03
IUPAC Name2,2-difluoropropan-1-amine;hydrochloride
SMILESCC(F)(F)CN.Cl
InChIInChI=1S/C3H7F2N.ClH/c1-3(4,5)2-6;/h2,6H2,1H3;1H
InChIKeyIDJKGOWDPKVIBR-UHFFFAOYSA-N
XLogP1.02
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.55
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,2-difluoropropan-1-amine;hydrochloride?
The IUPAC name of 2,2-difluoropropan-1-amine;hydrochloride (CID 2758355) is 2,2-difluoropropan-1-amine;hydrochloride.
What is the SMILES notation for 2,2-difluoropropan-1-amine;hydrochloride?
The canonical SMILES for 2,2-difluoropropan-1-amine;hydrochloride is CC(F)(F)CN.Cl.
What is the InChIKey of 2,2-difluoropropan-1-amine;hydrochloride?
The InChIKey is IDJKGOWDPKVIBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7F2N.ClH/c1-3(4,5)2-6;/h2,6H2,1H3;1H.
What are the key properties of 2,2-difluoropropan-1-amine;hydrochloride?
2,2-difluoropropan-1-amine;hydrochloride has a molecular weight of 131.55 g/mol, XLogP of 1.02, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluoropropan-1-amine;hydrochloride is sourced from PubChem (CID 2758355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).