(2R)-2-fluoropent-4-yn-1-amine

C5H8FN — CID 129393026

IUPAC(2R)-2-fluoropent-4-yn-1-amine
SMILESC#CC[C@@H](F)CN
InChIInChI=1S/C5H8FN/c1-2-3-5(6)4-7/h1,5H,3-4,7H2/t5-/m1/s1
InChIKeyYVHOMPZIJAFZSY-RXMQYKEDSA-N
MW101.12 g/mol
LogP0.31
Rot. Bonds2

About (2R)-2-fluoropent-4-yn-1-amine

(2R)-2-fluoropent-4-yn-1-amine (PubChem CID 129393026) has the molecular formula C5H8FN and a molecular weight of 101.12 g/mol. Its IUPAC name is (2R)-2-fluoropent-4-yn-1-amine.

Molecular Properties

Compound Name(2R)-2-fluoropent-4-yn-1-amine
PubChem CID129393026
Molecular FormulaC5H8FN
Molecular Weight101.12 g/mol
Exact Mass101.06
IUPAC Name(2R)-2-fluoropent-4-yn-1-amine
SMILESC#CC[C@@H](F)CN
InChIInChI=1S/C5H8FN/c1-2-3-5(6)4-7/h1,5H,3-4,7H2/t5-/m1/s1
InChIKeyYVHOMPZIJAFZSY-RXMQYKEDSA-N
XLogP0.31
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500101.12
LogP ≤ 50.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-fluoropent-4-yn-1-amine?
The IUPAC name of (2R)-2-fluoropent-4-yn-1-amine (CID 129393026) is (2R)-2-fluoropent-4-yn-1-amine.
What is the SMILES notation for (2R)-2-fluoropent-4-yn-1-amine?
The canonical SMILES for (2R)-2-fluoropent-4-yn-1-amine is C#CC[C@@H](F)CN.
What is the InChIKey of (2R)-2-fluoropent-4-yn-1-amine?
The InChIKey is YVHOMPZIJAFZSY-RXMQYKEDSA-N. The full InChI is InChI=1S/C5H8FN/c1-2-3-5(6)4-7/h1,5H,3-4,7H2/t5-/m1/s1.
What are the key properties of (2R)-2-fluoropent-4-yn-1-amine?
(2R)-2-fluoropent-4-yn-1-amine has a molecular weight of 101.12 g/mol, XLogP of 0.31, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-fluoropent-4-yn-1-amine is sourced from PubChem (CID 129393026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).