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

C5H10FN — CID 101435123

IUPAC(E)-3-fluoro-N,N-dimethylprop-1-en-1-amine
SMILESCN(C)/C=C/CF
InChIInChI=1S/C5H10FN/c1-7(2)5-3-4-6/h3,5H,4H2,1-2H3/b5-3+
InChIKeyDOUCRGQYHUSFQO-HWKANZROSA-N
MW103.14 g/mol
LogP1.03
Rot. Bonds2

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

(E)-3-fluoro-N,N-dimethylprop-1-en-1-amine (PubChem CID 101435123) has the molecular formula C5H10FN and a molecular weight of 103.14 g/mol. Its IUPAC name is (E)-3-fluoro-N,N-dimethylprop-1-en-1-amine.

Molecular Properties

Compound Name(E)-3-fluoro-N,N-dimethylprop-1-en-1-amine
PubChem CID101435123
Molecular FormulaC5H10FN
Molecular Weight103.14 g/mol
Exact Mass103.08
IUPAC Name(E)-3-fluoro-N,N-dimethylprop-1-en-1-amine
SMILESCN(C)/C=C/CF
InChIInChI=1S/C5H10FN/c1-7(2)5-3-4-6/h3,5H,4H2,1-2H3/b5-3+
InChIKeyDOUCRGQYHUSFQO-HWKANZROSA-N
XLogP1.03
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500103.14
LogP ≤ 51.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (E)-3-fluoro-N,N-dimethylprop-1-en-1-amine?
The IUPAC name of (E)-3-fluoro-N,N-dimethylprop-1-en-1-amine (CID 101435123) is (E)-3-fluoro-N,N-dimethylprop-1-en-1-amine.
What is the SMILES notation for (E)-3-fluoro-N,N-dimethylprop-1-en-1-amine?
The canonical SMILES for (E)-3-fluoro-N,N-dimethylprop-1-en-1-amine is CN(C)/C=C/CF.
What is the InChIKey of (E)-3-fluoro-N,N-dimethylprop-1-en-1-amine?
The InChIKey is DOUCRGQYHUSFQO-HWKANZROSA-N. The full InChI is InChI=1S/C5H10FN/c1-7(2)5-3-4-6/h3,5H,4H2,1-2H3/b5-3+.
What are the key properties of (E)-3-fluoro-N,N-dimethylprop-1-en-1-amine?
(E)-3-fluoro-N,N-dimethylprop-1-en-1-amine has a molecular weight of 103.14 g/mol, XLogP of 1.03, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-3-fluoro-N,N-dimethylprop-1-en-1-amine is sourced from PubChem (CID 101435123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).