N,N-dimethyl-2-(pyridin-2-ylmethylamino)benzamide

C15H17N3O — CID 43738317

IUPACN,N-dimethyl-2-(pyridin-2-ylmethylamino)benzamide
SMILESCN(C)C(=O)c1ccccc1NCc1ccccn1
InChIInChI=1S/C15H17N3O/c1-18(2)15(19)13-8-3-4-9-14(13)17-11-12-7-5-6-10-16-12/h3-10,17H,11H2,1-2H3
InChIKeyNQTWISWTYCEOAA-UHFFFAOYSA-N
MW255.32 g/mol
LogP2.40
Rot. Bonds4

About N,N-dimethyl-2-(pyridin-2-ylmethylamino)benzamide

N,N-dimethyl-2-(pyridin-2-ylmethylamino)benzamide (PubChem CID 43738317) has the molecular formula C15H17N3O and a molecular weight of 255.32 g/mol. Its IUPAC name is N,N-dimethyl-2-(pyridin-2-ylmethylamino)benzamide.

Molecular Properties

Compound NameN,N-dimethyl-2-(pyridin-2-ylmethylamino)benzamide
PubChem CID43738317
Molecular FormulaC15H17N3O
Molecular Weight255.32 g/mol
Exact Mass255.14
IUPAC NameN,N-dimethyl-2-(pyridin-2-ylmethylamino)benzamide
SMILESCN(C)C(=O)c1ccccc1NCc1ccccn1
InChIInChI=1S/C15H17N3O/c1-18(2)15(19)13-8-3-4-9-14(13)17-11-12-7-5-6-10-16-12/h3-10,17H,11H2,1-2H3
InChIKeyNQTWISWTYCEOAA-UHFFFAOYSA-N
XLogP2.40
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N,N-dimethyl-2-(pyridin-2-ylmethylamino)benzamide 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 N,N-dimethyl-2-(pyridin-2-ylmethylamino)benzamide?
The IUPAC name of N,N-dimethyl-2-(pyridin-2-ylmethylamino)benzamide (CID 43738317) is N,N-dimethyl-2-(pyridin-2-ylmethylamino)benzamide.
What is the SMILES notation for N,N-dimethyl-2-(pyridin-2-ylmethylamino)benzamide?
The canonical SMILES for N,N-dimethyl-2-(pyridin-2-ylmethylamino)benzamide is CN(C)C(=O)c1ccccc1NCc1ccccn1.
What is the InChIKey of N,N-dimethyl-2-(pyridin-2-ylmethylamino)benzamide?
The InChIKey is NQTWISWTYCEOAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O/c1-18(2)15(19)13-8-3-4-9-14(13)17-11-12-7-5-6-10-16-12/h3-10,17H,11H2,1-2H3.
What are the key properties of N,N-dimethyl-2-(pyridin-2-ylmethylamino)benzamide?
N,N-dimethyl-2-(pyridin-2-ylmethylamino)benzamide has a molecular weight of 255.32 g/mol, XLogP of 2.40, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-(pyridin-2-ylmethylamino)benzamide is sourced from PubChem (CID 43738317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).