3-pyridin-2-yl-N-(2,4,6-trimethylphenyl)propanamide

C17H20N2O — CID 47468107

IUPAC3-pyridin-2-yl-N-(2,4,6-trimethylphenyl)propanamide
SMILESCc1cc(C)c(NC(=O)CCc2ccccn2)c(C)c1
InChIInChI=1S/C17H20N2O/c1-12-10-13(2)17(14(3)11-12)19-16(20)8-7-15-6-4-5-9-18-15/h4-6,9-11H,7-8H2,1-3H3,(H,19,20)
InChIKeyRHBGYBUKCSCXQG-UHFFFAOYSA-N
MW268.36 g/mol
LogP3.58
Rot. Bonds4

About 3-pyridin-2-yl-N-(2,4,6-trimethylphenyl)propanamide

3-pyridin-2-yl-N-(2,4,6-trimethylphenyl)propanamide (PubChem CID 47468107) has the molecular formula C17H20N2O and a molecular weight of 268.36 g/mol. Its IUPAC name is 3-pyridin-2-yl-N-(2,4,6-trimethylphenyl)propanamide.

Molecular Properties

Compound Name3-pyridin-2-yl-N-(2,4,6-trimethylphenyl)propanamide
PubChem CID47468107
Molecular FormulaC17H20N2O
Molecular Weight268.36 g/mol
Exact Mass268.16
IUPAC Name3-pyridin-2-yl-N-(2,4,6-trimethylphenyl)propanamide
SMILESCc1cc(C)c(NC(=O)CCc2ccccn2)c(C)c1
InChIInChI=1S/C17H20N2O/c1-12-10-13(2)17(14(3)11-12)19-16(20)8-7-15-6-4-5-9-18-15/h4-6,9-11H,7-8H2,1-3H3,(H,19,20)
InChIKeyRHBGYBUKCSCXQG-UHFFFAOYSA-N
XLogP3.58
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,6-difluorophenyl)-3-pyridin-2-ylpropanamide
CID 110389270
1-N',2-N'-bis(2-pyridin-2-ylethyl)-1-N,2-N-bis(2,4,6-trimethylphenyl)ethanediimidamide
CID 101116594
N-(3-bromo-4-methylphenyl)-3-pyridin-2-ylpropanamide
CID 110389230
N-methyl-3-pyridin-2-ylpropanamide
CID 14093010
N-(6-acetamido-2-pyridinyl)-3-pyridin-2-ylpropanamide
CID 101146103
N-(4-hydroxyphenyl)-3-pyridin-2-ylpropanamide
CID 80743821
N-[3-(5-bromo-2-methylanilino)-3-oxopropyl]-3-pyridin-2-ylpropanamide
CID 60610354
1-N-(pyridin-2-ylmethyl)-3-N-(2,4,6-trimethylphenyl)benzene-1,3-dicarboxamide
CID 109055004
[2-oxo-2-[[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]ethyl] pyridine-2-carboxylate
CID 7477161
4-oxo-4-phenyl-N-(2,4,6-trimethylphenyl)butanamide
CID 78776242
N-[4-methyl-3-[(3-methylphenyl)sulfamoyl]phenyl]-3-pyridin-2-ylpropanamide
CID 60599848
2-(3-pyridin-2-ylpropanoylamino)benzoic acid
CID 110468304

Frequently Asked Questions

What is the IUPAC name of 3-pyridin-2-yl-N-(2,4,6-trimethylphenyl)propanamide?
The IUPAC name of 3-pyridin-2-yl-N-(2,4,6-trimethylphenyl)propanamide (CID 47468107) is 3-pyridin-2-yl-N-(2,4,6-trimethylphenyl)propanamide.
What is the SMILES notation for 3-pyridin-2-yl-N-(2,4,6-trimethylphenyl)propanamide?
The canonical SMILES for 3-pyridin-2-yl-N-(2,4,6-trimethylphenyl)propanamide is Cc1cc(C)c(NC(=O)CCc2ccccn2)c(C)c1.
What is the InChIKey of 3-pyridin-2-yl-N-(2,4,6-trimethylphenyl)propanamide?
The InChIKey is RHBGYBUKCSCXQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O/c1-12-10-13(2)17(14(3)11-12)19-16(20)8-7-15-6-4-5-9-18-15/h4-6,9-11H,7-8H2,1-3H3,(H,19,20).
What are the key properties of 3-pyridin-2-yl-N-(2,4,6-trimethylphenyl)propanamide?
3-pyridin-2-yl-N-(2,4,6-trimethylphenyl)propanamide has a molecular weight of 268.36 g/mol, XLogP of 3.58, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-pyridin-2-yl-N-(2,4,6-trimethylphenyl)propanamide is sourced from PubChem (CID 47468107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).