6-(N-ethyl-2-methylanilino)pyridine-2-carbonitrile

C15H15N3 — CID 64587866

IUPAC6-(N-ethyl-2-methylanilino)pyridine-2-carbonitrile
SMILESCCN(c1cccc(C#N)n1)c1ccccc1C
InChIInChI=1S/C15H15N3/c1-3-18(14-9-5-4-7-12(14)2)15-10-6-8-13(11-16)17-15/h4-10H,3H2,1-2H3
InChIKeyANEJKRNCXLKEFE-UHFFFAOYSA-N
MW237.31 g/mol
LogP3.42
Rot. Bonds3

About 6-(N-ethyl-2-methylanilino)pyridine-2-carbonitrile

6-(N-ethyl-2-methylanilino)pyridine-2-carbonitrile (PubChem CID 64587866) has the molecular formula C15H15N3 and a molecular weight of 237.31 g/mol. Its IUPAC name is 6-(N-ethyl-2-methylanilino)pyridine-2-carbonitrile.

Molecular Properties

Compound Name6-(N-ethyl-2-methylanilino)pyridine-2-carbonitrile
PubChem CID64587866
Molecular FormulaC15H15N3
Molecular Weight237.31 g/mol
Exact Mass237.13
IUPAC Name6-(N-ethyl-2-methylanilino)pyridine-2-carbonitrile
SMILESCCN(c1cccc(C#N)n1)c1ccccc1C
InChIInChI=1S/C15H15N3/c1-3-18(14-9-5-4-7-12(14)2)15-10-6-8-13(11-16)17-15/h4-10H,3H2,1-2H3
InChIKeyANEJKRNCXLKEFE-UHFFFAOYSA-N
XLogP3.42
TPSA39.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.31
LogP ≤ 53.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(N-ethyl-2-methylanilino)pyridine-2-carbonitrile?
The IUPAC name of 6-(N-ethyl-2-methylanilino)pyridine-2-carbonitrile (CID 64587866) is 6-(N-ethyl-2-methylanilino)pyridine-2-carbonitrile.
What is the SMILES notation for 6-(N-ethyl-2-methylanilino)pyridine-2-carbonitrile?
The canonical SMILES for 6-(N-ethyl-2-methylanilino)pyridine-2-carbonitrile is CCN(c1cccc(C#N)n1)c1ccccc1C.
What is the InChIKey of 6-(N-ethyl-2-methylanilino)pyridine-2-carbonitrile?
The InChIKey is ANEJKRNCXLKEFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3/c1-3-18(14-9-5-4-7-12(14)2)15-10-6-8-13(11-16)17-15/h4-10H,3H2,1-2H3.
What are the key properties of 6-(N-ethyl-2-methylanilino)pyridine-2-carbonitrile?
6-(N-ethyl-2-methylanilino)pyridine-2-carbonitrile has a molecular weight of 237.31 g/mol, XLogP of 3.42, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(N-ethyl-2-methylanilino)pyridine-2-carbonitrile is sourced from PubChem (CID 64587866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).