N,6-dimethyl-2-(4-methylanilino)pyridine-3-carboxamide

C15H17N3O — CID 3061038

IUPACN,6-dimethyl-2-(4-methylanilino)pyridine-3-carboxamide
SMILESCNC(=O)c1ccc(C)nc1Nc1ccc(C)cc1
InChIInChI=1S/C15H17N3O/c1-10-4-7-12(8-5-10)18-14-13(15(19)16-3)9-6-11(2)17-14/h4-9H,1-3H3,(H,16,19)(H,17,18)
InChIKeyREXNCPCFYOEOTM-UHFFFAOYSA-N
MW255.32 g/mol
LogP2.80
Rot. Bonds3

About N,6-dimethyl-2-(4-methylanilino)pyridine-3-carboxamide

N,6-dimethyl-2-(4-methylanilino)pyridine-3-carboxamide (PubChem CID 3061038) has the molecular formula C15H17N3O and a molecular weight of 255.32 g/mol. Its IUPAC name is N,6-dimethyl-2-(4-methylanilino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN,6-dimethyl-2-(4-methylanilino)pyridine-3-carboxamide
PubChem CID3061038
Molecular FormulaC15H17N3O
Molecular Weight255.32 g/mol
Exact Mass255.14
IUPAC NameN,6-dimethyl-2-(4-methylanilino)pyridine-3-carboxamide
SMILESCNC(=O)c1ccc(C)nc1Nc1ccc(C)cc1
InChIInChI=1S/C15H17N3O/c1-10-4-7-12(8-5-10)18-14-13(15(19)16-3)9-6-11(2)17-14/h4-9H,1-3H3,(H,16,19)(H,17,18)
InChIKeyREXNCPCFYOEOTM-UHFFFAOYSA-N
XLogP2.80
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 52.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,6-dimethyl-2-(4-methylanilino)pyridine-3-carboxamide?
The IUPAC name of N,6-dimethyl-2-(4-methylanilino)pyridine-3-carboxamide (CID 3061038) is N,6-dimethyl-2-(4-methylanilino)pyridine-3-carboxamide.
What is the SMILES notation for N,6-dimethyl-2-(4-methylanilino)pyridine-3-carboxamide?
The canonical SMILES for N,6-dimethyl-2-(4-methylanilino)pyridine-3-carboxamide is CNC(=O)c1ccc(C)nc1Nc1ccc(C)cc1.
What is the InChIKey of N,6-dimethyl-2-(4-methylanilino)pyridine-3-carboxamide?
The InChIKey is REXNCPCFYOEOTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O/c1-10-4-7-12(8-5-10)18-14-13(15(19)16-3)9-6-11(2)17-14/h4-9H,1-3H3,(H,16,19)(H,17,18).
What are the key properties of N,6-dimethyl-2-(4-methylanilino)pyridine-3-carboxamide?
N,6-dimethyl-2-(4-methylanilino)pyridine-3-carboxamide has a molecular weight of 255.32 g/mol, XLogP of 2.80, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,6-dimethyl-2-(4-methylanilino)pyridine-3-carboxamide is sourced from PubChem (CID 3061038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).