2-chloro-5-ethenylpyridin-3-amine

C7H7ClN2 — CID 74891699

IUPAC2-chloro-5-ethenylpyridin-3-amine
SMILESC=Cc1cnc(Cl)c(N)c1
InChIInChI=1S/C7H7ClN2/c1-2-5-3-6(9)7(8)10-4-5/h2-4H,1,9H2
InChIKeyYHGAAJYWNYLTJU-UHFFFAOYSA-N
MW154.60 g/mol
LogP1.96
Rot. Bonds1

About 2-chloro-5-ethenylpyridin-3-amine

2-chloro-5-ethenylpyridin-3-amine (PubChem CID 74891699) has the molecular formula C7H7ClN2 and a molecular weight of 154.60 g/mol. Its IUPAC name is 2-chloro-5-ethenylpyridin-3-amine.

Molecular Properties

Compound Name2-chloro-5-ethenylpyridin-3-amine
PubChem CID74891699
Molecular FormulaC7H7ClN2
Molecular Weight154.60 g/mol
Exact Mass154.03
IUPAC Name2-chloro-5-ethenylpyridin-3-amine
SMILESC=Cc1cnc(Cl)c(N)c1
InChIInChI=1S/C7H7ClN2/c1-2-5-3-6(9)7(8)10-4-5/h2-4H,1,9H2
InChIKeyYHGAAJYWNYLTJU-UHFFFAOYSA-N
XLogP1.96
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.60
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-ethenylpyridin-3-amine?
The IUPAC name of 2-chloro-5-ethenylpyridin-3-amine (CID 74891699) is 2-chloro-5-ethenylpyridin-3-amine.
What is the SMILES notation for 2-chloro-5-ethenylpyridin-3-amine?
The canonical SMILES for 2-chloro-5-ethenylpyridin-3-amine is C=Cc1cnc(Cl)c(N)c1.
What is the InChIKey of 2-chloro-5-ethenylpyridin-3-amine?
The InChIKey is YHGAAJYWNYLTJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7ClN2/c1-2-5-3-6(9)7(8)10-4-5/h2-4H,1,9H2.
What are the key properties of 2-chloro-5-ethenylpyridin-3-amine?
2-chloro-5-ethenylpyridin-3-amine has a molecular weight of 154.60 g/mol, XLogP of 1.96, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-ethenylpyridin-3-amine is sourced from PubChem (CID 74891699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).