(E)-3-fluoroprop-2-en-1-amine

C3H6FN — CID 19800330

IUPAC(E)-3-fluoroprop-2-en-1-amine
SMILESNC/C=C/F
InChIInChI=1S/C3H6FN/c4-2-1-3-5/h1-2H,3,5H2/b2-1+
InChIKeyDTGSMKHVQQJWTL-OWOJBTEDSA-N
MW75.09 g/mol
LogP0.43
Rot. Bonds1

About (E)-3-fluoroprop-2-en-1-amine

(E)-3-fluoroprop-2-en-1-amine (PubChem CID 19800330) has the molecular formula C3H6FN and a molecular weight of 75.09 g/mol. Its IUPAC name is (E)-3-fluoroprop-2-en-1-amine.

Molecular Properties

Compound Name(E)-3-fluoroprop-2-en-1-amine
PubChem CID19800330
Molecular FormulaC3H6FN
Molecular Weight75.09 g/mol
Exact Mass75.05
IUPAC Name(E)-3-fluoroprop-2-en-1-amine
SMILESNC/C=C/F
InChIInChI=1S/C3H6FN/c4-2-1-3-5/h1-2H,3,5H2/b2-1+
InChIKeyDTGSMKHVQQJWTL-OWOJBTEDSA-N
XLogP0.43
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50075.09
LogP ≤ 50.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (E)-3-fluoroprop-2-en-1-amine?
The IUPAC name of (E)-3-fluoroprop-2-en-1-amine (CID 19800330) is (E)-3-fluoroprop-2-en-1-amine.
What is the SMILES notation for (E)-3-fluoroprop-2-en-1-amine?
The canonical SMILES for (E)-3-fluoroprop-2-en-1-amine is NC/C=C/F.
What is the InChIKey of (E)-3-fluoroprop-2-en-1-amine?
The InChIKey is DTGSMKHVQQJWTL-OWOJBTEDSA-N. The full InChI is InChI=1S/C3H6FN/c4-2-1-3-5/h1-2H,3,5H2/b2-1+.
What are the key properties of (E)-3-fluoroprop-2-en-1-amine?
(E)-3-fluoroprop-2-en-1-amine has a molecular weight of 75.09 g/mol, XLogP of 0.43, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-3-fluoroprop-2-en-1-amine is sourced from PubChem (CID 19800330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).