6-chloro-5-methylpyridin-2-amine

C6H7ClN2 — CID 45079594

IUPAC6-chloro-5-methylpyridin-2-amine
SMILESCc1ccc(N)nc1Cl
InChIInChI=1S/C6H7ClN2/c1-4-2-3-5(8)9-6(4)7/h2-3H,1H3,(H2,8,9)
InChIKeyKPZRCZMNXPBHEH-UHFFFAOYSA-N
MW142.59 g/mol
LogP1.63
Rot. Bonds

About 6-chloro-5-methylpyridin-2-amine

6-chloro-5-methylpyridin-2-amine (PubChem CID 45079594) has the molecular formula C6H7ClN2 and a molecular weight of 142.59 g/mol. Its IUPAC name is 6-chloro-5-methylpyridin-2-amine.

Molecular Properties

Compound Name6-chloro-5-methylpyridin-2-amine
PubChem CID45079594
Molecular FormulaC6H7ClN2
Molecular Weight142.59 g/mol
Exact Mass142.03
IUPAC Name6-chloro-5-methylpyridin-2-amine
SMILESCc1ccc(N)nc1Cl
InChIInChI=1S/C6H7ClN2/c1-4-2-3-5(8)9-6(4)7/h2-3H,1H3,(H2,8,9)
InChIKeyKPZRCZMNXPBHEH-UHFFFAOYSA-N
XLogP1.63
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.59
LogP ≤ 51.63
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 6-chloro-5-methylpyridin-2-amine?
The IUPAC name of 6-chloro-5-methylpyridin-2-amine (CID 45079594) is 6-chloro-5-methylpyridin-2-amine.
What is the SMILES notation for 6-chloro-5-methylpyridin-2-amine?
The canonical SMILES for 6-chloro-5-methylpyridin-2-amine is Cc1ccc(N)nc1Cl.
What is the InChIKey of 6-chloro-5-methylpyridin-2-amine?
The InChIKey is KPZRCZMNXPBHEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7ClN2/c1-4-2-3-5(8)9-6(4)7/h2-3H,1H3,(H2,8,9).
What are the key properties of 6-chloro-5-methylpyridin-2-amine?
6-chloro-5-methylpyridin-2-amine has a molecular weight of 142.59 g/mol, XLogP of 1.63, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-5-methylpyridin-2-amine is sourced from PubChem (CID 45079594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).