N,6-dimethyl-N-(pyrrolidin-2-ylmethyl)pyridine-3-carboxamide

C13H19N3O — CID 106607470

IUPACN,6-dimethyl-N-(pyrrolidin-2-ylmethyl)pyridine-3-carboxamide
SMILESCc1ccc(C(=O)N(C)CC2CCCN2)cn1
InChIInChI=1S/C13H19N3O/c1-10-5-6-11(8-15-10)13(17)16(2)9-12-4-3-7-14-12/h5-6,8,12,14H,3-4,7,9H2,1-2H3
InChIKeyYTJFELTVQQMDHU-UHFFFAOYSA-N
MW233.31 g/mol
LogP1.21
Rot. Bonds3

About N,6-dimethyl-N-(pyrrolidin-2-ylmethyl)pyridine-3-carboxamide

N,6-dimethyl-N-(pyrrolidin-2-ylmethyl)pyridine-3-carboxamide (PubChem CID 106607470) has the molecular formula C13H19N3O and a molecular weight of 233.31 g/mol. Its IUPAC name is N,6-dimethyl-N-(pyrrolidin-2-ylmethyl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN,6-dimethyl-N-(pyrrolidin-2-ylmethyl)pyridine-3-carboxamide
PubChem CID106607470
Molecular FormulaC13H19N3O
Molecular Weight233.31 g/mol
Exact Mass233.15
IUPAC NameN,6-dimethyl-N-(pyrrolidin-2-ylmethyl)pyridine-3-carboxamide
SMILESCc1ccc(C(=O)N(C)CC2CCCN2)cn1
InChIInChI=1S/C13H19N3O/c1-10-5-6-11(8-15-10)13(17)16(2)9-12-4-3-7-14-12/h5-6,8,12,14H,3-4,7,9H2,1-2H3
InChIKeyYTJFELTVQQMDHU-UHFFFAOYSA-N
XLogP1.21
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N,6-dimethyl-N-(pyrrolidin-2-ylmethyl)pyridine-3-carboxamide 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,6-dimethyl-N-(pyrrolidin-2-ylmethyl)pyridine-3-carboxamide?
The IUPAC name of N,6-dimethyl-N-(pyrrolidin-2-ylmethyl)pyridine-3-carboxamide (CID 106607470) is N,6-dimethyl-N-(pyrrolidin-2-ylmethyl)pyridine-3-carboxamide.
What is the SMILES notation for N,6-dimethyl-N-(pyrrolidin-2-ylmethyl)pyridine-3-carboxamide?
The canonical SMILES for N,6-dimethyl-N-(pyrrolidin-2-ylmethyl)pyridine-3-carboxamide is Cc1ccc(C(=O)N(C)CC2CCCN2)cn1.
What is the InChIKey of N,6-dimethyl-N-(pyrrolidin-2-ylmethyl)pyridine-3-carboxamide?
The InChIKey is YTJFELTVQQMDHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O/c1-10-5-6-11(8-15-10)13(17)16(2)9-12-4-3-7-14-12/h5-6,8,12,14H,3-4,7,9H2,1-2H3.
What are the key properties of N,6-dimethyl-N-(pyrrolidin-2-ylmethyl)pyridine-3-carboxamide?
N,6-dimethyl-N-(pyrrolidin-2-ylmethyl)pyridine-3-carboxamide has a molecular weight of 233.31 g/mol, XLogP of 1.21, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,6-dimethyl-N-(pyrrolidin-2-ylmethyl)pyridine-3-carboxamide is sourced from PubChem (CID 106607470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).