4-chloropyridin-2-amine

C5H5ClN2 — CID 581866

IUPAC4-chloropyridin-2-amine
SMILESNc1cc(Cl)ccn1
InChIInChI=1S/C5H5ClN2/c6-4-1-2-8-5(7)3-4/h1-3H,(H2,7,8)
InChIKeyRQMWVVBHJMUJNZ-UHFFFAOYSA-N
MW128.56 g/mol
LogP1.32
Rot. Bonds

About 4-chloropyridin-2-amine

4-chloropyridin-2-amine (PubChem CID 581866) has the molecular formula C5H5ClN2 and a molecular weight of 128.56 g/mol. Its IUPAC name is 4-chloropyridin-2-amine.

Molecular Properties

Compound Name4-chloropyridin-2-amine
PubChem CID581866
Molecular FormulaC5H5ClN2
Molecular Weight128.56 g/mol
Exact Mass128.01
IUPAC Name4-chloropyridin-2-amine
SMILESNc1cc(Cl)ccn1
InChIInChI=1S/C5H5ClN2/c6-4-1-2-8-5(7)3-4/h1-3H,(H2,7,8)
InChIKeyRQMWVVBHJMUJNZ-UHFFFAOYSA-N
XLogP1.32
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.56
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-chloropyridin-2-amine?
The IUPAC name of 4-chloropyridin-2-amine (CID 581866) is 4-chloropyridin-2-amine.
What is the SMILES notation for 4-chloropyridin-2-amine?
The canonical SMILES for 4-chloropyridin-2-amine is Nc1cc(Cl)ccn1.
What is the InChIKey of 4-chloropyridin-2-amine?
The InChIKey is RQMWVVBHJMUJNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5ClN2/c6-4-1-2-8-5(7)3-4/h1-3H,(H2,7,8).
What are the key properties of 4-chloropyridin-2-amine?
4-chloropyridin-2-amine has a molecular weight of 128.56 g/mol, XLogP of 1.32, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloropyridin-2-amine is sourced from PubChem (CID 581866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).