5-chloro-2-(ethylamino)-6-methylpyridine-3-carbonitrile

C9H10ClN3 — CID 155040649

IUPAC5-chloro-2-(ethylamino)-6-methylpyridine-3-carbonitrile
SMILESCCNc1nc(C)c(Cl)cc1C#N
InChIInChI=1S/C9H10ClN3/c1-3-12-9-7(5-11)4-8(10)6(2)13-9/h4H,3H2,1-2H3,(H,12,13)
InChIKeyCNZHSCBJGJNDLL-UHFFFAOYSA-N
MW195.65 g/mol
LogP2.35
Rot. Bonds2

About 5-chloro-2-(ethylamino)-6-methylpyridine-3-carbonitrile

5-chloro-2-(ethylamino)-6-methylpyridine-3-carbonitrile (PubChem CID 155040649) has the molecular formula C9H10ClN3 and a molecular weight of 195.65 g/mol. Its IUPAC name is 5-chloro-2-(ethylamino)-6-methylpyridine-3-carbonitrile.

Molecular Properties

Compound Name5-chloro-2-(ethylamino)-6-methylpyridine-3-carbonitrile
PubChem CID155040649
Molecular FormulaC9H10ClN3
Molecular Weight195.65 g/mol
Exact Mass195.06
IUPAC Name5-chloro-2-(ethylamino)-6-methylpyridine-3-carbonitrile
SMILESCCNc1nc(C)c(Cl)cc1C#N
InChIInChI=1S/C9H10ClN3/c1-3-12-9-7(5-11)4-8(10)6(2)13-9/h4H,3H2,1-2H3,(H,12,13)
InChIKeyCNZHSCBJGJNDLL-UHFFFAOYSA-N
XLogP2.35
TPSA48.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.65
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-chloro-2-(ethylamino)-6-methylpyridine-3-carbonitrile with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-(ethylamino)-6-methylpyridine-3-carbonitrile?
The IUPAC name of 5-chloro-2-(ethylamino)-6-methylpyridine-3-carbonitrile (CID 155040649) is 5-chloro-2-(ethylamino)-6-methylpyridine-3-carbonitrile.
What is the SMILES notation for 5-chloro-2-(ethylamino)-6-methylpyridine-3-carbonitrile?
The canonical SMILES for 5-chloro-2-(ethylamino)-6-methylpyridine-3-carbonitrile is CCNc1nc(C)c(Cl)cc1C#N.
What is the InChIKey of 5-chloro-2-(ethylamino)-6-methylpyridine-3-carbonitrile?
The InChIKey is CNZHSCBJGJNDLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10ClN3/c1-3-12-9-7(5-11)4-8(10)6(2)13-9/h4H,3H2,1-2H3,(H,12,13).
What are the key properties of 5-chloro-2-(ethylamino)-6-methylpyridine-3-carbonitrile?
5-chloro-2-(ethylamino)-6-methylpyridine-3-carbonitrile has a molecular weight of 195.65 g/mol, XLogP of 2.35, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-(ethylamino)-6-methylpyridine-3-carbonitrile is sourced from PubChem (CID 155040649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).