(E)-1,3,3,3-tetrafluoro-N,N-dimethylprop-1-en-1-amine

C5H7F4N — CID 149463255

IUPAC(E)-1,3,3,3-tetrafluoro-N,N-dimethylprop-1-en-1-amine
SMILESCN(C)/C(F)=C\C(F)(F)F
InChIInChI=1S/C5H7F4N/c1-10(2)4(6)3-5(7,8)9/h3H,1-2H3/b4-3-
InChIKeyYZXOWRKKCWHQRX-ARJAWSKDSA-N
MW157.11 g/mol
LogP1.92
Rot. Bonds1

About (E)-1,3,3,3-tetrafluoro-N,N-dimethylprop-1-en-1-amine

(E)-1,3,3,3-tetrafluoro-N,N-dimethylprop-1-en-1-amine (PubChem CID 149463255) has the molecular formula C5H7F4N and a molecular weight of 157.11 g/mol. Its IUPAC name is (E)-1,3,3,3-tetrafluoro-N,N-dimethylprop-1-en-1-amine.

Molecular Properties

Compound Name(E)-1,3,3,3-tetrafluoro-N,N-dimethylprop-1-en-1-amine
PubChem CID149463255
Molecular FormulaC5H7F4N
Molecular Weight157.11 g/mol
Exact Mass157.05
IUPAC Name(E)-1,3,3,3-tetrafluoro-N,N-dimethylprop-1-en-1-amine
SMILESCN(C)/C(F)=C\C(F)(F)F
InChIInChI=1S/C5H7F4N/c1-10(2)4(6)3-5(7,8)9/h3H,1-2H3/b4-3-
InChIKeyYZXOWRKKCWHQRX-ARJAWSKDSA-N
XLogP1.92
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.11
LogP ≤ 51.92
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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Frequently Asked Questions

What is the IUPAC name of (E)-1,3,3,3-tetrafluoro-N,N-dimethylprop-1-en-1-amine?
The IUPAC name of (E)-1,3,3,3-tetrafluoro-N,N-dimethylprop-1-en-1-amine (CID 149463255) is (E)-1,3,3,3-tetrafluoro-N,N-dimethylprop-1-en-1-amine.
What is the SMILES notation for (E)-1,3,3,3-tetrafluoro-N,N-dimethylprop-1-en-1-amine?
The canonical SMILES for (E)-1,3,3,3-tetrafluoro-N,N-dimethylprop-1-en-1-amine is CN(C)/C(F)=C\C(F)(F)F.
What is the InChIKey of (E)-1,3,3,3-tetrafluoro-N,N-dimethylprop-1-en-1-amine?
The InChIKey is YZXOWRKKCWHQRX-ARJAWSKDSA-N. The full InChI is InChI=1S/C5H7F4N/c1-10(2)4(6)3-5(7,8)9/h3H,1-2H3/b4-3-.
What are the key properties of (E)-1,3,3,3-tetrafluoro-N,N-dimethylprop-1-en-1-amine?
(E)-1,3,3,3-tetrafluoro-N,N-dimethylprop-1-en-1-amine has a molecular weight of 157.11 g/mol, XLogP of 1.92, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1,3,3,3-tetrafluoro-N,N-dimethylprop-1-en-1-amine is sourced from PubChem (CID 149463255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).