2-[methyl(pyridin-3-ylcarbamoyl)amino]-N-(2,4,6-trimethylphenyl)acetamide

C18H22N4O2 — CID 51264566

IUPAC2-[methyl(pyridin-3-ylcarbamoyl)amino]-N-(2,4,6-trimethylphenyl)acetamide
SMILESCc1cc(C)c(NC(=O)CN(C)C(=O)Nc2cccnc2)c(C)c1
InChIInChI=1S/C18H22N4O2/c1-12-8-13(2)17(14(3)9-12)21-16(23)11-22(4)18(24)20-15-6-5-7-19-10-15/h5-10H,11H2,1-4H3,(H,20,24)(H,21,23)
InChIKeyGHLDHZXFRIHOKJ-UHFFFAOYSA-N
MW326.40 g/mol
LogP3.11
Rot. Bonds4

About 2-[methyl(pyridin-3-ylcarbamoyl)amino]-N-(2,4,6-trimethylphenyl)acetamide

2-[methyl(pyridin-3-ylcarbamoyl)amino]-N-(2,4,6-trimethylphenyl)acetamide (PubChem CID 51264566) has the molecular formula C18H22N4O2 and a molecular weight of 326.40 g/mol. Its IUPAC name is 2-[methyl(pyridin-3-ylcarbamoyl)amino]-N-(2,4,6-trimethylphenyl)acetamide.

Molecular Properties

Compound Name2-[methyl(pyridin-3-ylcarbamoyl)amino]-N-(2,4,6-trimethylphenyl)acetamide
PubChem CID51264566
Molecular FormulaC18H22N4O2
Molecular Weight326.40 g/mol
Exact Mass326.17
IUPAC Name2-[methyl(pyridin-3-ylcarbamoyl)amino]-N-(2,4,6-trimethylphenyl)acetamide
SMILESCc1cc(C)c(NC(=O)CN(C)C(=O)Nc2cccnc2)c(C)c1
InChIInChI=1S/C18H22N4O2/c1-12-8-13(2)17(14(3)9-12)21-16(23)11-22(4)18(24)20-15-6-5-7-19-10-15/h5-10H,11H2,1-4H3,(H,20,24)(H,21,23)
InChIKeyGHLDHZXFRIHOKJ-UHFFFAOYSA-N
XLogP3.11
TPSA74.33 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 53.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(4-fluorophenyl)carbamoyl-methylamino]-N-(2,4,6-trimethylphenyl)acetamide
CID 27869376
2-[(4-methoxyphenyl)carbamoyl-methylamino]-N-(2,4,6-trimethylphenyl)acetamide
CID 51226266
2-pyridin-3-yl-N-(2,4,6-trimethylphenyl)acetamide
CID 110697139
2-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]-N-phenylacetamide
CID 9339160
3-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]-N-phenylpropanamide
CID 17498635
1-methyl-1-[2-(3-methylphenoxy)ethyl]-3-pyridin-3-ylurea
CID 18101625
1-ethyl-1-hydroxy-3-pyridin-3-ylurea
CID 130385554
2-(dimethylamino)-N-(2,4,6-trimethylphenyl)acetamide;hydrochloride
CID 138400573
2-amino-N-methyl-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]acetamide
CID 119291379
3-(3-imidazol-1-ylpropanoylamino)-N-methyl-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]benzamide
CID 55985388
1-[(3-fluorophenyl)methyl]-1-methyl-3-pyridin-3-ylurea
CID 17403084
1-[2-(dimethylamino)ethyl]-1-(pyridin-3-ylmethyl)-3-(2,4,6-trimethylphenyl)urea
CID 87008900

Frequently Asked Questions

What is the IUPAC name of 2-[methyl(pyridin-3-ylcarbamoyl)amino]-N-(2,4,6-trimethylphenyl)acetamide?
The IUPAC name of 2-[methyl(pyridin-3-ylcarbamoyl)amino]-N-(2,4,6-trimethylphenyl)acetamide (CID 51264566) is 2-[methyl(pyridin-3-ylcarbamoyl)amino]-N-(2,4,6-trimethylphenyl)acetamide.
What is the SMILES notation for 2-[methyl(pyridin-3-ylcarbamoyl)amino]-N-(2,4,6-trimethylphenyl)acetamide?
The canonical SMILES for 2-[methyl(pyridin-3-ylcarbamoyl)amino]-N-(2,4,6-trimethylphenyl)acetamide is Cc1cc(C)c(NC(=O)CN(C)C(=O)Nc2cccnc2)c(C)c1.
What is the InChIKey of 2-[methyl(pyridin-3-ylcarbamoyl)amino]-N-(2,4,6-trimethylphenyl)acetamide?
The InChIKey is GHLDHZXFRIHOKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N4O2/c1-12-8-13(2)17(14(3)9-12)21-16(23)11-22(4)18(24)20-15-6-5-7-19-10-15/h5-10H,11H2,1-4H3,(H,20,24)(H,21,23).
What are the key properties of 2-[methyl(pyridin-3-ylcarbamoyl)amino]-N-(2,4,6-trimethylphenyl)acetamide?
2-[methyl(pyridin-3-ylcarbamoyl)amino]-N-(2,4,6-trimethylphenyl)acetamide has a molecular weight of 326.40 g/mol, XLogP of 3.11, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl(pyridin-3-ylcarbamoyl)amino]-N-(2,4,6-trimethylphenyl)acetamide is sourced from PubChem (CID 51264566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).