3-chloropyridin-2-amine

C5H5ClN2 — CID 693267

IUPAC3-chloropyridin-2-amine
SMILESNc1ncccc1Cl
InChIInChI=1S/C5H5ClN2/c6-4-2-1-3-8-5(4)7/h1-3H,(H2,7,8)
InChIKeyRZJPBQGRCNJYBU-UHFFFAOYSA-N
MW128.56 g/mol
LogP1.32
Rot. Bonds

About 3-chloropyridin-2-amine

3-chloropyridin-2-amine (PubChem CID 693267) has the molecular formula C5H5ClN2 and a molecular weight of 128.56 g/mol. Its IUPAC name is 3-chloropyridin-2-amine.

Molecular Properties

Compound Name3-chloropyridin-2-amine
PubChem CID693267
Molecular FormulaC5H5ClN2
Molecular Weight128.56 g/mol
Exact Mass128.01
IUPAC Name3-chloropyridin-2-amine
SMILESNc1ncccc1Cl
InChIInChI=1S/C5H5ClN2/c6-4-2-1-3-8-5(4)7/h1-3H,(H2,7,8)
InChIKeyRZJPBQGRCNJYBU-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 3-chloropyridin-2-amine?
The IUPAC name of 3-chloropyridin-2-amine (CID 693267) is 3-chloropyridin-2-amine.
What is the SMILES notation for 3-chloropyridin-2-amine?
The canonical SMILES for 3-chloropyridin-2-amine is Nc1ncccc1Cl.
What is the InChIKey of 3-chloropyridin-2-amine?
The InChIKey is RZJPBQGRCNJYBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5ClN2/c6-4-2-1-3-8-5(4)7/h1-3H,(H2,7,8).
What are the key properties of 3-chloropyridin-2-amine?
3-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 3-chloropyridin-2-amine is sourced from PubChem (CID 693267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).