ethane;2-methylpyridine;pyridin-3-amine

C13H19N3 — CID 143747996

IUPACethane;2-methylpyridine;pyridin-3-amine
SMILESCC.Cc1ccccn1.Nc1cccnc1
InChIInChI=1S/C6H7N.C5H6N2.C2H6/c1-6-4-2-3-5-7-6;6-5-2-1-3-7-4-5;1-2/h2-5H,1H3;1-4H,6H2;1-2H3
InChIKeyHXGYLSHDHKQYGO-UHFFFAOYSA-N
MW217.32 g/mol
LogP3.08
Rot. Bonds

About ethane;2-methylpyridine;pyridin-3-amine

ethane;2-methylpyridine;pyridin-3-amine (PubChem CID 143747996) has the molecular formula C13H19N3 and a molecular weight of 217.32 g/mol. Its IUPAC name is ethane;2-methylpyridine;pyridin-3-amine.

Molecular Properties

Compound Nameethane;2-methylpyridine;pyridin-3-amine
PubChem CID143747996
Molecular FormulaC13H19N3
Molecular Weight217.32 g/mol
Exact Mass217.16
IUPAC Nameethane;2-methylpyridine;pyridin-3-amine
SMILESCC.Cc1ccccn1.Nc1cccnc1
InChIInChI=1S/C6H7N.C5H6N2.C2H6/c1-6-4-2-3-5-7-6;6-5-2-1-3-7-4-5;1-2/h2-5H,1H3;1-4H,6H2;1-2H3
InChIKeyHXGYLSHDHKQYGO-UHFFFAOYSA-N
XLogP3.08
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.32
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze ethane;2-methylpyridine;pyridin-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

ethane;2-methylpyrazine;2-methylpyridine;3-methylpyridine
CID 167693533
2-methylpyridine;pyridine
CID 19753594
iron;pyridin-3-amine
CID 174751178
bis(pyridin-3-amine);hydrate
CID 172803625
hydrogen peroxide;pyridin-3-amine
CID 87884226
ethane;2-methylpyridine;3-methylpyridine;4-methylpyridine;toluene
CID 158312228
molecular hydrogen;propane;pyridin-3-amine
CID 156868620
2-methylpyridine;3-methylpyridine;4-methylpyridine;toluene
CID 157092955
ethane;2-methylpyridine;toluene
CID 143164268
magnesium;hydride;2-methylpyridine;hydroiodide
CID 174750573
2,2-dimethylpropane;2-methylpyridine
CID 159740552
ethane;3-methylpyridazine;2-methylpyridine;3-methylpyridine;toluene
CID 158912509

Frequently Asked Questions

What is the IUPAC name of ethane;2-methylpyridine;pyridin-3-amine?
The IUPAC name of ethane;2-methylpyridine;pyridin-3-amine (CID 143747996) is ethane;2-methylpyridine;pyridin-3-amine.
What is the SMILES notation for ethane;2-methylpyridine;pyridin-3-amine?
The canonical SMILES for ethane;2-methylpyridine;pyridin-3-amine is CC.Cc1ccccn1.Nc1cccnc1.
What is the InChIKey of ethane;2-methylpyridine;pyridin-3-amine?
The InChIKey is HXGYLSHDHKQYGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7N.C5H6N2.C2H6/c1-6-4-2-3-5-7-6;6-5-2-1-3-7-4-5;1-2/h2-5H,1H3;1-4H,6H2;1-2H3.
What are the key properties of ethane;2-methylpyridine;pyridin-3-amine?
ethane;2-methylpyridine;pyridin-3-amine has a molecular weight of 217.32 g/mol, XLogP of 3.08, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-methylpyridine;pyridin-3-amine is sourced from PubChem (CID 143747996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).