5-(4-chlorophenyl)-6-ethylpyridin-2-amine

C13H13ClN2 — CID 58709674

IUPAC5-(4-chlorophenyl)-6-ethylpyridin-2-amine
SMILESCCc1nc(N)ccc1-c1ccc(Cl)cc1
InChIInChI=1S/C13H13ClN2/c1-2-12-11(7-8-13(15)16-12)9-3-5-10(14)6-4-9/h3-8H,2H2,1H3,(H2,15,16)
InChIKeyPDZTVLJVXPTCNI-UHFFFAOYSA-N
MW232.71 g/mol
LogP3.55
Rot. Bonds2

About 5-(4-chlorophenyl)-6-ethylpyridin-2-amine

5-(4-chlorophenyl)-6-ethylpyridin-2-amine (PubChem CID 58709674) has the molecular formula C13H13ClN2 and a molecular weight of 232.71 g/mol. Its IUPAC name is 5-(4-chlorophenyl)-6-ethylpyridin-2-amine.

Molecular Properties

Compound Name5-(4-chlorophenyl)-6-ethylpyridin-2-amine
PubChem CID58709674
Molecular FormulaC13H13ClN2
Molecular Weight232.71 g/mol
Exact Mass232.08
IUPAC Name5-(4-chlorophenyl)-6-ethylpyridin-2-amine
SMILESCCc1nc(N)ccc1-c1ccc(Cl)cc1
InChIInChI=1S/C13H13ClN2/c1-2-12-11(7-8-13(15)16-12)9-3-5-10(14)6-4-9/h3-8H,2H2,1H3,(H2,15,16)
InChIKeyPDZTVLJVXPTCNI-UHFFFAOYSA-N
XLogP3.55
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.71
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-(4-chlorophenyl)-6-ethylpyridin-2-amine?
The IUPAC name of 5-(4-chlorophenyl)-6-ethylpyridin-2-amine (CID 58709674) is 5-(4-chlorophenyl)-6-ethylpyridin-2-amine.
What is the SMILES notation for 5-(4-chlorophenyl)-6-ethylpyridin-2-amine?
The canonical SMILES for 5-(4-chlorophenyl)-6-ethylpyridin-2-amine is CCc1nc(N)ccc1-c1ccc(Cl)cc1.
What is the InChIKey of 5-(4-chlorophenyl)-6-ethylpyridin-2-amine?
The InChIKey is PDZTVLJVXPTCNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13ClN2/c1-2-12-11(7-8-13(15)16-12)9-3-5-10(14)6-4-9/h3-8H,2H2,1H3,(H2,15,16).
What are the key properties of 5-(4-chlorophenyl)-6-ethylpyridin-2-amine?
5-(4-chlorophenyl)-6-ethylpyridin-2-amine has a molecular weight of 232.71 g/mol, XLogP of 3.55, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-chlorophenyl)-6-ethylpyridin-2-amine is sourced from PubChem (CID 58709674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).