2-N-[4-(dimethylamino)phenyl]-6-N,6-N-dipropylpyridine-2,6-dicarboxamide

C21H28N4O2 — CID 109099834

IUPAC2-N-[4-(dimethylamino)phenyl]-6-N,6-N-dipropylpyridine-2,6-dicarboxamide
SMILESCCCN(CCC)C(=O)c1cccc(C(=O)Nc2ccc(N(C)C)cc2)n1
InChIInChI=1S/C21H28N4O2/c1-5-14-25(15-6-2)21(27)19-9-7-8-18(23-19)20(26)22-16-10-12-17(13-11-16)24(3)4/h7-13H,5-6,14-15H2,1-4H3,(H,22,26)
InChIKeyDWYAMUDYBBHDGL-UHFFFAOYSA-N
MW368.48 g/mol
LogP3.66
Rot. Bonds8

About 2-N-[4-(dimethylamino)phenyl]-6-N,6-N-dipropylpyridine-2,6-dicarboxamide

2-N-[4-(dimethylamino)phenyl]-6-N,6-N-dipropylpyridine-2,6-dicarboxamide (PubChem CID 109099834) has the molecular formula C21H28N4O2 and a molecular weight of 368.48 g/mol. Its IUPAC name is 2-N-[4-(dimethylamino)phenyl]-6-N,6-N-dipropylpyridine-2,6-dicarboxamide.

Molecular Properties

Compound Name2-N-[4-(dimethylamino)phenyl]-6-N,6-N-dipropylpyridine-2,6-dicarboxamide
PubChem CID109099834
Molecular FormulaC21H28N4O2
Molecular Weight368.48 g/mol
Exact Mass368.22
IUPAC Name2-N-[4-(dimethylamino)phenyl]-6-N,6-N-dipropylpyridine-2,6-dicarboxamide
SMILESCCCN(CCC)C(=O)c1cccc(C(=O)Nc2ccc(N(C)C)cc2)n1
InChIInChI=1S/C21H28N4O2/c1-5-14-25(15-6-2)21(27)19-9-7-8-18(23-19)20(26)22-16-10-12-17(13-11-16)24(3)4/h7-13H,5-6,14-15H2,1-4H3,(H,22,26)
InChIKeyDWYAMUDYBBHDGL-UHFFFAOYSA-N
XLogP3.66
TPSA65.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.48
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

Analyze 2-N-[4-(dimethylamino)phenyl]-6-N,6-N-dipropylpyridine-2,6-dicarboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-N-[4-(diethylamino)phenyl]-6-N,6-N-dipropylpyridine-2,6-dicarboxamide
CID 109099835
2-N-[2-(dimethylamino)ethyl]-6-N-[4-(dimethylamino)phenyl]pyridine-2,6-dicarboxamide
CID 109096394
2-N,6-N-bis[4-(diethylamino)phenyl]pyridine-2,6-dicarboxamide
CID 1019302
6-amino-N-[4-(dimethylamino)phenyl]pyridine-2-carboxamide
CID 62239989
6-bromo-N-[4-(dimethylamino)phenyl]pyridine-2-carboxamide
CID 113343282
6-N-cyclopropyl-2-N-[4-(dimethylamino)phenyl]pyridine-2,6-dicarboxamide
CID 109093956
6-N-[4-(dimethylamino)phenyl]-2-N-(furan-2-ylmethyl)pyridine-2,6-dicarboxamide
CID 109097185
2-N-pentyl-6-N,6-N-dipropylpyridine-2,6-dicarboxamide
CID 109099433
6-N,6-N-diethyl-2-N-(4-propan-2-ylphenyl)pyridine-2,6-dicarboxamide
CID 109098987
6-N-butyl-2-N-(4-tert-butylphenyl)-6-N-methylpyridine-2,6-dicarboxamide
CID 109099555
6-(cyclopropylamino)-N-[4-(dimethylamino)phenyl]pyridine-2-carboxamide
CID 84573387
2-N-[2-(dimethylamino)ethyl]-6-N-(4-ethylphenyl)pyridine-2,6-dicarboxamide
CID 109096349

Frequently Asked Questions

What is the IUPAC name of 2-N-[4-(dimethylamino)phenyl]-6-N,6-N-dipropylpyridine-2,6-dicarboxamide?
The IUPAC name of 2-N-[4-(dimethylamino)phenyl]-6-N,6-N-dipropylpyridine-2,6-dicarboxamide (CID 109099834) is 2-N-[4-(dimethylamino)phenyl]-6-N,6-N-dipropylpyridine-2,6-dicarboxamide.
What is the SMILES notation for 2-N-[4-(dimethylamino)phenyl]-6-N,6-N-dipropylpyridine-2,6-dicarboxamide?
The canonical SMILES for 2-N-[4-(dimethylamino)phenyl]-6-N,6-N-dipropylpyridine-2,6-dicarboxamide is CCCN(CCC)C(=O)c1cccc(C(=O)Nc2ccc(N(C)C)cc2)n1.
What is the InChIKey of 2-N-[4-(dimethylamino)phenyl]-6-N,6-N-dipropylpyridine-2,6-dicarboxamide?
The InChIKey is DWYAMUDYBBHDGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H28N4O2/c1-5-14-25(15-6-2)21(27)19-9-7-8-18(23-19)20(26)22-16-10-12-17(13-11-16)24(3)4/h7-13H,5-6,14-15H2,1-4H3,(H,22,26).
What are the key properties of 2-N-[4-(dimethylamino)phenyl]-6-N,6-N-dipropylpyridine-2,6-dicarboxamide?
2-N-[4-(dimethylamino)phenyl]-6-N,6-N-dipropylpyridine-2,6-dicarboxamide has a molecular weight of 368.48 g/mol, XLogP of 3.66, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-[4-(dimethylamino)phenyl]-6-N,6-N-dipropylpyridine-2,6-dicarboxamide is sourced from PubChem (CID 109099834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).