1,1-difluoro-N,N-dimethylmethanamine

C3H7F2N — CID 2758304

IUPAC1,1-difluoro-N,N-dimethylmethanamine
SMILESCN(C)C(F)F
InChIInChI=1S/C3H7F2N/c1-6(2)3(4)5/h3H,1-2H3
InChIKeyPULPCFLUVFWKAF-UHFFFAOYSA-N
MW95.09 g/mol
LogP0.77
Rot. Bonds1

About 1,1-difluoro-N,N-dimethylmethanamine

1,1-difluoro-N,N-dimethylmethanamine (PubChem CID 2758304) has the molecular formula C3H7F2N and a molecular weight of 95.09 g/mol. Its IUPAC name is 1,1-difluoro-N,N-dimethylmethanamine.

Molecular Properties

Compound Name1,1-difluoro-N,N-dimethylmethanamine
PubChem CID2758304
Molecular FormulaC3H7F2N
Molecular Weight95.09 g/mol
Exact Mass95.05
IUPAC Name1,1-difluoro-N,N-dimethylmethanamine
SMILESCN(C)C(F)F
InChIInChI=1S/C3H7F2N/c1-6(2)3(4)5/h3H,1-2H3
InChIKeyPULPCFLUVFWKAF-UHFFFAOYSA-N
XLogP0.77
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50095.09
LogP ≤ 50.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-C-halo', 'substructure': 'N/A'}

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Related Compounds

1,1,1-Trifluorotrimethylamine
CID 136481
Bis(trifluoromethyl)methylamine
CID 12804489
Trimethyl(trifluoromethyl)azanium
CID 12654533
Difluoromethyl(trimethyl)azanium
CID 13440986
Fluoroform;tetramethylazanium
CID 22401043
Dimethyl-bis(trifluoromethyl)azanium
CID 22460902
1-fluoro-N,N-bis(fluoromethyl)methanamine
CID 22605203
CID 45087477
CID 45087477
Methyl(trifluoromethyl)azanide
CID 59171439
N-(difluoromethyl)-1,1-difluoro-N-(fluoromethyl)methanamine
CID 85733874
1,1-difluoro-1-iodo-N,N-dimethylmethanamine
CID 88506972
1-fluoro-N-(fluoromethyl)-N-methylmethanamine
CID 140581343

Frequently Asked Questions

What is the IUPAC name of 1,1-difluoro-N,N-dimethylmethanamine?
The IUPAC name of 1,1-difluoro-N,N-dimethylmethanamine (CID 2758304) is 1,1-difluoro-N,N-dimethylmethanamine.
What is the SMILES notation for 1,1-difluoro-N,N-dimethylmethanamine?
The canonical SMILES for 1,1-difluoro-N,N-dimethylmethanamine is CN(C)C(F)F.
What is the InChIKey of 1,1-difluoro-N,N-dimethylmethanamine?
The InChIKey is PULPCFLUVFWKAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7F2N/c1-6(2)3(4)5/h3H,1-2H3.
What are the key properties of 1,1-difluoro-N,N-dimethylmethanamine?
1,1-difluoro-N,N-dimethylmethanamine has a molecular weight of 95.09 g/mol, XLogP of 0.77, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-difluoro-N,N-dimethylmethanamine is sourced from PubChem (CID 2758304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).