2-chloro-5-methylpyridin-4-amine

C6H7ClN2 — CID 12643706

IUPAC2-chloro-5-methylpyridin-4-amine
SMILESCc1cnc(Cl)cc1N
InChIInChI=1S/C6H7ClN2/c1-4-3-9-6(7)2-5(4)8/h2-3H,1H3,(H2,8,9)
InChIKeyCJGKOPNIXJWHKF-UHFFFAOYSA-N
MW142.59 g/mol
LogP1.63
Rot. Bonds

About 2-chloro-5-methylpyridin-4-amine

2-chloro-5-methylpyridin-4-amine (PubChem CID 12643706) has the molecular formula C6H7ClN2 and a molecular weight of 142.59 g/mol. Its IUPAC name is 2-chloro-5-methylpyridin-4-amine.

Molecular Properties

Compound Name2-chloro-5-methylpyridin-4-amine
PubChem CID12643706
Molecular FormulaC6H7ClN2
Molecular Weight142.59 g/mol
Exact Mass142.03
IUPAC Name2-chloro-5-methylpyridin-4-amine
SMILESCc1cnc(Cl)cc1N
InChIInChI=1S/C6H7ClN2/c1-4-3-9-6(7)2-5(4)8/h2-3H,1H3,(H2,8,9)
InChIKeyCJGKOPNIXJWHKF-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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Related Compounds

CID 1727
CID 1727
CID 19967186
CID 19967186
CID 80528
CID 80528
CID 50293
CID 50293
CID 92342
CID 92342
CID 11094883
CID 11094883
CID 581853
CID 581853
CID 74811
CID 74811
CID 89888
CID 89888
CID 11344811
CID 11344811
CID 581393
CID 581393
CID 7020927
CID 7020927

Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-methylpyridin-4-amine?
The IUPAC name of 2-chloro-5-methylpyridin-4-amine (CID 12643706) is 2-chloro-5-methylpyridin-4-amine.
What is the SMILES notation for 2-chloro-5-methylpyridin-4-amine?
The canonical SMILES for 2-chloro-5-methylpyridin-4-amine is Cc1cnc(Cl)cc1N.
What is the InChIKey of 2-chloro-5-methylpyridin-4-amine?
The InChIKey is CJGKOPNIXJWHKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7ClN2/c1-4-3-9-6(7)2-5(4)8/h2-3H,1H3,(H2,8,9).
What are the key properties of 2-chloro-5-methylpyridin-4-amine?
2-chloro-5-methylpyridin-4-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 2-chloro-5-methylpyridin-4-amine is sourced from PubChem (CID 12643706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).