6-chloropyridin-2-amine;ethane

C7H11ClN2 — CID 143370846

IUPAC6-chloropyridin-2-amine;ethane
SMILESCC.Nc1cccc(Cl)n1
InChIInChI=1S/C5H5ClN2.C2H6/c6-4-2-1-3-5(7)8-4;1-2/h1-3H,(H2,7,8);1-2H3
InChIKeyJXJGNJYVRMVSTB-UHFFFAOYSA-N
MW158.63 g/mol
LogP2.34
Rot. Bonds

About 6-chloropyridin-2-amine;ethane

6-chloropyridin-2-amine;ethane (PubChem CID 143370846) has the molecular formula C7H11ClN2 and a molecular weight of 158.63 g/mol. Its IUPAC name is 6-chloropyridin-2-amine;ethane.

Molecular Properties

Compound Name6-chloropyridin-2-amine;ethane
PubChem CID143370846
Molecular FormulaC7H11ClN2
Molecular Weight158.63 g/mol
Exact Mass158.06
IUPAC Name6-chloropyridin-2-amine;ethane
SMILESCC.Nc1cccc(Cl)n1
InChIInChI=1S/C5H5ClN2.C2H6/c6-4-2-1-3-5(7)8-4;1-2/h1-3H,(H2,7,8);1-2H3
InChIKeyJXJGNJYVRMVSTB-UHFFFAOYSA-N
XLogP2.34
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.63
LogP ≤ 52.34
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-chloropyridin-2-amine;ethane?
The IUPAC name of 6-chloropyridin-2-amine;ethane (CID 143370846) is 6-chloropyridin-2-amine;ethane.
What is the SMILES notation for 6-chloropyridin-2-amine;ethane?
The canonical SMILES for 6-chloropyridin-2-amine;ethane is CC.Nc1cccc(Cl)n1.
What is the InChIKey of 6-chloropyridin-2-amine;ethane?
The InChIKey is JXJGNJYVRMVSTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5ClN2.C2H6/c6-4-2-1-3-5(7)8-4;1-2/h1-3H,(H2,7,8);1-2H3.
What are the key properties of 6-chloropyridin-2-amine;ethane?
6-chloropyridin-2-amine;ethane has a molecular weight of 158.63 g/mol, XLogP of 2.34, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloropyridin-2-amine;ethane is sourced from PubChem (CID 143370846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).