4-[2-(dimethylamino)ethylamino]-N-(2-methyl-6-propan-2-ylphenyl)pyridine-2-carboxamide

C20H28N4O — CID 109207358

IUPAC4-[2-(dimethylamino)ethylamino]-N-(2-methyl-6-propan-2-ylphenyl)pyridine-2-carboxamide
SMILESCc1cccc(C(C)C)c1NC(=O)c1cc(NCCN(C)C)ccn1
InChIInChI=1S/C20H28N4O/c1-14(2)17-8-6-7-15(3)19(17)23-20(25)18-13-16(9-10-22-18)21-11-12-24(4)5/h6-10,13-14H,11-12H2,1-5H3,(H,21,22)(H,23,25)
InChIKeyFHGGAQVDVCYWJP-UHFFFAOYSA-N
MW340.47 g/mol
LogP3.74
Rot. Bonds7

About 4-[2-(dimethylamino)ethylamino]-N-(2-methyl-6-propan-2-ylphenyl)pyridine-2-carboxamide

4-[2-(dimethylamino)ethylamino]-N-(2-methyl-6-propan-2-ylphenyl)pyridine-2-carboxamide (PubChem CID 109207358) has the molecular formula C20H28N4O and a molecular weight of 340.47 g/mol. Its IUPAC name is 4-[2-(dimethylamino)ethylamino]-N-(2-methyl-6-propan-2-ylphenyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name4-[2-(dimethylamino)ethylamino]-N-(2-methyl-6-propan-2-ylphenyl)pyridine-2-carboxamide
PubChem CID109207358
Molecular FormulaC20H28N4O
Molecular Weight340.47 g/mol
Exact Mass340.23
IUPAC Name4-[2-(dimethylamino)ethylamino]-N-(2-methyl-6-propan-2-ylphenyl)pyridine-2-carboxamide
SMILESCc1cccc(C(C)C)c1NC(=O)c1cc(NCCN(C)C)ccn1
InChIInChI=1S/C20H28N4O/c1-14(2)17-8-6-7-15(3)19(17)23-20(25)18-13-16(9-10-22-18)21-11-12-24(4)5/h6-10,13-14H,11-12H2,1-5H3,(H,21,22)(H,23,25)
InChIKeyFHGGAQVDVCYWJP-UHFFFAOYSA-N
XLogP3.74
TPSA57.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.47
LogP ≤ 53.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2,6-di(propan-2-yl)phenyl]-4-(propylamino)pyridine-2-carboxamide
CID 109201269
4-[2-(dimethylamino)ethylamino]-N-(2,5-dimethylphenyl)pyridine-2-carboxamide
CID 109207345
4-(1,3-benzodioxol-5-ylamino)-N-(2-methyl-6-propan-2-ylphenyl)pyridine-2-carboxamide
CID 109220544
N-(4-chlorophenyl)-4-[2-(dimethylamino)ethylamino]pyridine-2-carboxamide
CID 109207365
N-(4-chloro-2-methylphenyl)-4-[2-(dimethylamino)ethylamino]pyridine-2-carboxamide
CID 109207368
2-N-(3-fluorophenyl)-4-N-(2-methyl-6-propan-2-ylphenyl)pyridine-2,4-dicarboxamide
CID 109092550
4-[2-(dimethylamino)ethylamino]-N-[3-(dimethylamino)propyl]pyridine-2-carboxamide
CID 109207266
N-(2,6-dimethylphenyl)-4-[2-(4-fluorophenyl)ethylamino]pyridine-2-carboxamide
CID 109214209
N-butyl-4-(2-methyl-6-propan-2-ylanilino)pyridine-2-carboxamide
CID 109202571
N-[2-(dimethylamino)ethyl]-5-(2-methyl-6-propan-2-ylanilino)pyridine-2-carboxamide
CID 109185373
N-(2-propan-2-ylphenyl)-4-(propylamino)pyridine-2-carboxamide
CID 109201226
2-[2-(dimethylamino)ethylamino]-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 2112763

Frequently Asked Questions

What is the IUPAC name of 4-[2-(dimethylamino)ethylamino]-N-(2-methyl-6-propan-2-ylphenyl)pyridine-2-carboxamide?
The IUPAC name of 4-[2-(dimethylamino)ethylamino]-N-(2-methyl-6-propan-2-ylphenyl)pyridine-2-carboxamide (CID 109207358) is 4-[2-(dimethylamino)ethylamino]-N-(2-methyl-6-propan-2-ylphenyl)pyridine-2-carboxamide.
What is the SMILES notation for 4-[2-(dimethylamino)ethylamino]-N-(2-methyl-6-propan-2-ylphenyl)pyridine-2-carboxamide?
The canonical SMILES for 4-[2-(dimethylamino)ethylamino]-N-(2-methyl-6-propan-2-ylphenyl)pyridine-2-carboxamide is Cc1cccc(C(C)C)c1NC(=O)c1cc(NCCN(C)C)ccn1.
What is the InChIKey of 4-[2-(dimethylamino)ethylamino]-N-(2-methyl-6-propan-2-ylphenyl)pyridine-2-carboxamide?
The InChIKey is FHGGAQVDVCYWJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H28N4O/c1-14(2)17-8-6-7-15(3)19(17)23-20(25)18-13-16(9-10-22-18)21-11-12-24(4)5/h6-10,13-14H,11-12H2,1-5H3,(H,21,22)(H,23,25).
What are the key properties of 4-[2-(dimethylamino)ethylamino]-N-(2-methyl-6-propan-2-ylphenyl)pyridine-2-carboxamide?
4-[2-(dimethylamino)ethylamino]-N-(2-methyl-6-propan-2-ylphenyl)pyridine-2-carboxamide has a molecular weight of 340.47 g/mol, XLogP of 3.74, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(dimethylamino)ethylamino]-N-(2-methyl-6-propan-2-ylphenyl)pyridine-2-carboxamide is sourced from PubChem (CID 109207358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).