1-fluoropent-3-en-2-amine

C5H10FN — CID 54234781

IUPAC1-fluoropent-3-en-2-amine
SMILESCC=CC(N)CF
InChIInChI=1S/C5H10FN/c1-2-3-5(7)4-6/h2-3,5H,4,7H2,1H3
InChIKeyQLTWOIUWCBOVSY-UHFFFAOYSA-N
MW103.14 g/mol
LogP0.86
Rot. Bonds2

About 1-fluoropent-3-en-2-amine

1-fluoropent-3-en-2-amine (PubChem CID 54234781) has the molecular formula C5H10FN and a molecular weight of 103.14 g/mol. Its IUPAC name is 1-fluoropent-3-en-2-amine.

Molecular Properties

Compound Name1-fluoropent-3-en-2-amine
PubChem CID54234781
Molecular FormulaC5H10FN
Molecular Weight103.14 g/mol
Exact Mass103.08
IUPAC Name1-fluoropent-3-en-2-amine
SMILESCC=CC(N)CF
InChIInChI=1S/C5H10FN/c1-2-3-5(7)4-6/h2-3,5H,4,7H2,1H3
InChIKeyQLTWOIUWCBOVSY-UHFFFAOYSA-N
XLogP0.86
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500103.14
LogP ≤ 50.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

alpha-(Fluoromethyl)dehydroputrescine
CID 6439606
But-3-en-2-amine
CID 15584178
5,5-Difluoro-pent-2-ene-1,4-diamine
CID 20466280
(2R)-But-3-en-2-amine
CID 21082342
(2E)-pent-2-en-1-amine hydrochloride
CID 121552531
2-Hexenylamine
CID 10492355
Pent-3-enylamine
CID 5466580
4-Methylcyclohexa-2,5-dien-1-amine
CID 42627495
1-Amino-pent-3-ene
CID 533840
4-Methylpent-3-en-2-amine
CID 14949967
Hex-2-en-1-amine
CID 53415109
(Z)-pent-3-en-2-amine
CID 101928412

Frequently Asked Questions

What is the IUPAC name of 1-fluoropent-3-en-2-amine?
The IUPAC name of 1-fluoropent-3-en-2-amine (CID 54234781) is 1-fluoropent-3-en-2-amine.
What is the SMILES notation for 1-fluoropent-3-en-2-amine?
The canonical SMILES for 1-fluoropent-3-en-2-amine is CC=CC(N)CF.
What is the InChIKey of 1-fluoropent-3-en-2-amine?
The InChIKey is QLTWOIUWCBOVSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10FN/c1-2-3-5(7)4-6/h2-3,5H,4,7H2,1H3.
What are the key properties of 1-fluoropent-3-en-2-amine?
1-fluoropent-3-en-2-amine has a molecular weight of 103.14 g/mol, XLogP of 0.86, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoropent-3-en-2-amine is sourced from PubChem (CID 54234781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).