1-fluoro-N-(fluoromethyl)-N-methylmethanamine;1,1,1-trifluoro-N-methyl-N-(trifluoromethyl)methanamine

C6H10F8N2 — CID 158402630

IUPAC1-fluoro-N-(fluoromethyl)-N-methylmethanamine;1,1,1-trifluoro-N-methyl-N-(trifluoromethyl)methanamine
SMILESCN(C(F)(F)F)C(F)(F)F.CN(CF)CF
InChIInChI=1S/C3H3F6N.C3H7F2N/c1-10(2(4,5)6)3(7,8)9;1-6(2-4)3-5/h1H3;2-3H2,1H3
InChIKeyGYHFRPZBGCLOAQ-UHFFFAOYSA-N
MW262.14 g/mol
LogP2.73
Rot. Bonds2

About 1-fluoro-N-(fluoromethyl)-N-methylmethanamine;1,1,1-trifluoro-N-methyl-N-(trifluoromethyl)methanamine

1-fluoro-N-(fluoromethyl)-N-methylmethanamine;1,1,1-trifluoro-N-methyl-N-(trifluoromethyl)methanamine (PubChem CID 158402630) has the molecular formula C6H10F8N2 and a molecular weight of 262.14 g/mol. Its IUPAC name is 1-fluoro-N-(fluoromethyl)-N-methylmethanamine;1,1,1-trifluoro-N-methyl-N-(trifluoromethyl)methanamine.

Molecular Properties

Compound Name1-fluoro-N-(fluoromethyl)-N-methylmethanamine;1,1,1-trifluoro-N-methyl-N-(trifluoromethyl)methanamine
PubChem CID158402630
Molecular FormulaC6H10F8N2
Molecular Weight262.14 g/mol
Exact Mass262.07
IUPAC Name1-fluoro-N-(fluoromethyl)-N-methylmethanamine;1,1,1-trifluoro-N-methyl-N-(trifluoromethyl)methanamine
SMILESCN(C(F)(F)F)C(F)(F)F.CN(CF)CF
InChIInChI=1S/C3H3F6N.C3H7F2N/c1-10(2(4,5)6)3(7,8)9;1-6(2-4)3-5/h1H3;2-3H2,1H3
InChIKeyGYHFRPZBGCLOAQ-UHFFFAOYSA-N
XLogP2.73
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.14
LogP ≤ 52.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-fluoro-N-(fluoromethyl)-N-methylmethanamine;1,1,1-trifluoro-N-methyl-N-(trifluoromethyl)methanamine?
The IUPAC name of 1-fluoro-N-(fluoromethyl)-N-methylmethanamine;1,1,1-trifluoro-N-methyl-N-(trifluoromethyl)methanamine (CID 158402630) is 1-fluoro-N-(fluoromethyl)-N-methylmethanamine;1,1,1-trifluoro-N-methyl-N-(trifluoromethyl)methanamine.
What is the SMILES notation for 1-fluoro-N-(fluoromethyl)-N-methylmethanamine;1,1,1-trifluoro-N-methyl-N-(trifluoromethyl)methanamine?
The canonical SMILES for 1-fluoro-N-(fluoromethyl)-N-methylmethanamine;1,1,1-trifluoro-N-methyl-N-(trifluoromethyl)methanamine is CN(C(F)(F)F)C(F)(F)F.CN(CF)CF.
What is the InChIKey of 1-fluoro-N-(fluoromethyl)-N-methylmethanamine;1,1,1-trifluoro-N-methyl-N-(trifluoromethyl)methanamine?
The InChIKey is GYHFRPZBGCLOAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H3F6N.C3H7F2N/c1-10(2(4,5)6)3(7,8)9;1-6(2-4)3-5/h1H3;2-3H2,1H3.
What are the key properties of 1-fluoro-N-(fluoromethyl)-N-methylmethanamine;1,1,1-trifluoro-N-methyl-N-(trifluoromethyl)methanamine?
1-fluoro-N-(fluoromethyl)-N-methylmethanamine;1,1,1-trifluoro-N-methyl-N-(trifluoromethyl)methanamine has a molecular weight of 262.14 g/mol, XLogP of 2.73, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoro-N-(fluoromethyl)-N-methylmethanamine;1,1,1-trifluoro-N-methyl-N-(trifluoromethyl)methanamine is sourced from PubChem (CID 158402630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).