N-[2-(dimethylamino)phenyl]-2-(methylamino)pyridine-3-carboxamide

C15H18N4O — CID 106760745

IUPACN-[2-(dimethylamino)phenyl]-2-(methylamino)pyridine-3-carboxamide
SMILESCNc1ncccc1C(=O)Nc1ccccc1N(C)C
InChIInChI=1S/C15H18N4O/c1-16-14-11(7-6-10-17-14)15(20)18-12-8-4-5-9-13(12)19(2)3/h4-10H,1-3H3,(H,16,17)(H,18,20)
InChIKeyNJMJENPRSRBBQG-UHFFFAOYSA-N
MW270.34 g/mol
LogP2.44
Rot. Bonds4

About N-[2-(dimethylamino)phenyl]-2-(methylamino)pyridine-3-carboxamide

N-[2-(dimethylamino)phenyl]-2-(methylamino)pyridine-3-carboxamide (PubChem CID 106760745) has the molecular formula C15H18N4O and a molecular weight of 270.34 g/mol. Its IUPAC name is N-[2-(dimethylamino)phenyl]-2-(methylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)phenyl]-2-(methylamino)pyridine-3-carboxamide
PubChem CID106760745
Molecular FormulaC15H18N4O
Molecular Weight270.34 g/mol
Exact Mass270.15
IUPAC NameN-[2-(dimethylamino)phenyl]-2-(methylamino)pyridine-3-carboxamide
SMILESCNc1ncccc1C(=O)Nc1ccccc1N(C)C
InChIInChI=1S/C15H18N4O/c1-16-14-11(7-6-10-17-14)15(20)18-12-8-4-5-9-13(12)19(2)3/h4-10H,1-3H3,(H,16,17)(H,18,20)
InChIKeyNJMJENPRSRBBQG-UHFFFAOYSA-N
XLogP2.44
TPSA57.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 52.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)phenyl]-2-(methylamino)pyridine-3-carboxamide?
The IUPAC name of N-[2-(dimethylamino)phenyl]-2-(methylamino)pyridine-3-carboxamide (CID 106760745) is N-[2-(dimethylamino)phenyl]-2-(methylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-[2-(dimethylamino)phenyl]-2-(methylamino)pyridine-3-carboxamide?
The canonical SMILES for N-[2-(dimethylamino)phenyl]-2-(methylamino)pyridine-3-carboxamide is CNc1ncccc1C(=O)Nc1ccccc1N(C)C.
What is the InChIKey of N-[2-(dimethylamino)phenyl]-2-(methylamino)pyridine-3-carboxamide?
The InChIKey is NJMJENPRSRBBQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O/c1-16-14-11(7-6-10-17-14)15(20)18-12-8-4-5-9-13(12)19(2)3/h4-10H,1-3H3,(H,16,17)(H,18,20).
What are the key properties of N-[2-(dimethylamino)phenyl]-2-(methylamino)pyridine-3-carboxamide?
N-[2-(dimethylamino)phenyl]-2-(methylamino)pyridine-3-carboxamide has a molecular weight of 270.34 g/mol, XLogP of 2.44, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)phenyl]-2-(methylamino)pyridine-3-carboxamide is sourced from PubChem (CID 106760745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).