6-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]-N-propylpyridine-3-carboxamide

C21H28N4O2 — CID 133359145

IUPAC6-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]-N-propylpyridine-3-carboxamide
SMILESCCCNC(=O)c1ccc(N(C)CC(=O)Nc2c(C)cc(C)cc2C)nc1
InChIInChI=1S/C21H28N4O2/c1-6-9-22-21(27)17-7-8-18(23-12-17)25(5)13-19(26)24-20-15(3)10-14(2)11-16(20)4/h7-8,10-12H,6,9,13H2,1-5H3,(H,22,27)(H,24,26)
InChIKeyLFWSHIHTQZPNFN-UHFFFAOYSA-N
MW368.48 g/mol
LogP3.22
Rot. Bonds7

About 6-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]-N-propylpyridine-3-carboxamide

6-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]-N-propylpyridine-3-carboxamide (PubChem CID 133359145) has the molecular formula C21H28N4O2 and a molecular weight of 368.48 g/mol. Its IUPAC name is 6-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]-N-propylpyridine-3-carboxamide.

Molecular Properties

Compound Name6-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]-N-propylpyridine-3-carboxamide
PubChem CID133359145
Molecular FormulaC21H28N4O2
Molecular Weight368.48 g/mol
Exact Mass368.22
IUPAC Name6-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]-N-propylpyridine-3-carboxamide
SMILESCCCNC(=O)c1ccc(N(C)CC(=O)Nc2c(C)cc(C)cc2C)nc1
InChIInChI=1S/C21H28N4O2/c1-6-9-22-21(27)17-7-8-18(23-12-17)25(5)13-19(26)24-20-15(3)10-14(2)11-16(20)4/h7-8,10-12H,6,9,13H2,1-5H3,(H,22,27)(H,24,26)
InChIKeyLFWSHIHTQZPNFN-UHFFFAOYSA-N
XLogP3.22
TPSA74.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.48
LogP ≤ 53.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 6-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]-N-propylpyridine-3-carboxamide with MolForge

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Related Compounds

6-[[2-(2,6-dimethylanilino)-2-oxoethyl]-methylamino]-N-prop-2-enylpyridine-3-carboxamide
CID 133334436
2-[methyl-(5-nitro-2-pyridinyl)amino]-N-(2,4,6-trimethylphenyl)acetamide
CID 30640551
3-N-propyl-5-N-(2,4,6-trimethylphenyl)pyridine-3,5-dicarboxamide
CID 109101238
2-[[5-(4-ethyl-6-oxo-1H-pyrimidin-2-yl)-2-pyridinyl]-methylamino]-N-(2,4,6-trimethylphenyl)acetamide
CID 137269939
2-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]pyridine-4-carboxamide
CID 75377260
6-methoxy-N-methyl-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]pyridine-3-carboxamide
CID 27016019
4-bromo-N-[3-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]-3-oxopropyl]benzamide
CID 26714808
2-[[2-(2-chloro-4,6-dimethylanilino)-2-oxoethyl]-methylamino]-N-propylacetamide
CID 9289324
2-[(5-amino-4-methyl-2-pyridinyl)-methylamino]-N-propylacetamide
CID 79173345
N-ethyl-6-[[(2S)-2-hydroxypropyl]-methylamino]pyridine-3-carboxamide
CID 99778610
4-chloro-N-methyl-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]benzamide
CID 27783986
2-(dimethylamino)-N-(2,4,6-trimethylphenyl)acetamide;hydrochloride
CID 138400573

Frequently Asked Questions

What is the IUPAC name of 6-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]-N-propylpyridine-3-carboxamide?
The IUPAC name of 6-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]-N-propylpyridine-3-carboxamide (CID 133359145) is 6-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]-N-propylpyridine-3-carboxamide.
What is the SMILES notation for 6-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]-N-propylpyridine-3-carboxamide?
The canonical SMILES for 6-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]-N-propylpyridine-3-carboxamide is CCCNC(=O)c1ccc(N(C)CC(=O)Nc2c(C)cc(C)cc2C)nc1.
What is the InChIKey of 6-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]-N-propylpyridine-3-carboxamide?
The InChIKey is LFWSHIHTQZPNFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H28N4O2/c1-6-9-22-21(27)17-7-8-18(23-12-17)25(5)13-19(26)24-20-15(3)10-14(2)11-16(20)4/h7-8,10-12H,6,9,13H2,1-5H3,(H,22,27)(H,24,26).
What are the key properties of 6-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]-N-propylpyridine-3-carboxamide?
6-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]-N-propylpyridine-3-carboxamide has a molecular weight of 368.48 g/mol, XLogP of 3.22, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]-N-propylpyridine-3-carboxamide is sourced from PubChem (CID 133359145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).