2-anilino-N-ethyl-6-methylpyridine-3-carboxamide

C15H17N3O — CID 3061040

IUPAC2-anilino-N-ethyl-6-methylpyridine-3-carboxamide
SMILESCCNC(=O)c1ccc(C)nc1Nc1ccccc1
InChIInChI=1S/C15H17N3O/c1-3-16-15(19)13-10-9-11(2)17-14(13)18-12-7-5-4-6-8-12/h4-10H,3H2,1-2H3,(H,16,19)(H,17,18)
InChIKeyDBPJBGGAFKSAML-UHFFFAOYSA-N
MW255.32 g/mol
LogP2.88
Rot. Bonds4

About 2-anilino-N-ethyl-6-methylpyridine-3-carboxamide

2-anilino-N-ethyl-6-methylpyridine-3-carboxamide (PubChem CID 3061040) has the molecular formula C15H17N3O and a molecular weight of 255.32 g/mol. Its IUPAC name is 2-anilino-N-ethyl-6-methylpyridine-3-carboxamide.

Molecular Properties

Compound Name2-anilino-N-ethyl-6-methylpyridine-3-carboxamide
PubChem CID3061040
Molecular FormulaC15H17N3O
Molecular Weight255.32 g/mol
Exact Mass255.14
IUPAC Name2-anilino-N-ethyl-6-methylpyridine-3-carboxamide
SMILESCCNC(=O)c1ccc(C)nc1Nc1ccccc1
InChIInChI=1S/C15H17N3O/c1-3-16-15(19)13-10-9-11(2)17-14(13)18-12-7-5-4-6-8-12/h4-10H,3H2,1-2H3,(H,16,19)(H,17,18)
InChIKeyDBPJBGGAFKSAML-UHFFFAOYSA-N
XLogP2.88
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 52.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-anilino-N-ethyl-6-methylpyridine-3-carboxamide?
The IUPAC name of 2-anilino-N-ethyl-6-methylpyridine-3-carboxamide (CID 3061040) is 2-anilino-N-ethyl-6-methylpyridine-3-carboxamide.
What is the SMILES notation for 2-anilino-N-ethyl-6-methylpyridine-3-carboxamide?
The canonical SMILES for 2-anilino-N-ethyl-6-methylpyridine-3-carboxamide is CCNC(=O)c1ccc(C)nc1Nc1ccccc1.
What is the InChIKey of 2-anilino-N-ethyl-6-methylpyridine-3-carboxamide?
The InChIKey is DBPJBGGAFKSAML-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O/c1-3-16-15(19)13-10-9-11(2)17-14(13)18-12-7-5-4-6-8-12/h4-10H,3H2,1-2H3,(H,16,19)(H,17,18).
What are the key properties of 2-anilino-N-ethyl-6-methylpyridine-3-carboxamide?
2-anilino-N-ethyl-6-methylpyridine-3-carboxamide has a molecular weight of 255.32 g/mol, XLogP of 2.88, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-anilino-N-ethyl-6-methylpyridine-3-carboxamide is sourced from PubChem (CID 3061040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).