N-(2,4-dimethylphenyl)-2-(pyridin-2-ylmethylamino)acetamide

C16H19N3O — CID 108999125

IUPACN-(2,4-dimethylphenyl)-2-(pyridin-2-ylmethylamino)acetamide
SMILESCc1ccc(NC(=O)CNCc2ccccn2)c(C)c1
InChIInChI=1S/C16H19N3O/c1-12-6-7-15(13(2)9-12)19-16(20)11-17-10-14-5-3-4-8-18-14/h3-9,17H,10-11H2,1-2H3,(H,19,20)
InChIKeyVDVYWCWQALFKHZ-UHFFFAOYSA-N
MW269.35 g/mol
LogP2.43
Rot. Bonds5

About N-(2,4-dimethylphenyl)-2-(pyridin-2-ylmethylamino)acetamide

N-(2,4-dimethylphenyl)-2-(pyridin-2-ylmethylamino)acetamide (PubChem CID 108999125) has the molecular formula C16H19N3O and a molecular weight of 269.35 g/mol. Its IUPAC name is N-(2,4-dimethylphenyl)-2-(pyridin-2-ylmethylamino)acetamide.

Molecular Properties

Compound NameN-(2,4-dimethylphenyl)-2-(pyridin-2-ylmethylamino)acetamide
PubChem CID108999125
Molecular FormulaC16H19N3O
Molecular Weight269.35 g/mol
Exact Mass269.15
IUPAC NameN-(2,4-dimethylphenyl)-2-(pyridin-2-ylmethylamino)acetamide
SMILESCc1ccc(NC(=O)CNCc2ccccn2)c(C)c1
InChIInChI=1S/C16H19N3O/c1-12-6-7-15(13(2)9-12)19-16(20)11-17-10-14-5-3-4-8-18-14/h3-9,17H,10-11H2,1-2H3,(H,19,20)
InChIKeyVDVYWCWQALFKHZ-UHFFFAOYSA-N
XLogP2.43
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-chloro-4-methylphenyl)-2-(pyridin-2-ylmethylamino)acetamide
CID 108999138
1-(4-methylphenyl)-2-(pyridin-2-ylmethylamino)ethanone
CID 82101225
N-(2,4-dimethylphenyl)-2-[2-(2-pyridin-2-ylethyl)-1,3-thiazol-4-yl]acetamide
CID 110389560
N-(2-phenylsulfanylphenyl)-2-(pyridin-2-ylmethylamino)acetamide
CID 2104273
N-(2,4-dimethylphenyl)-3-pyridin-2-ylsulfanylpropanamide
CID 23833046
N'-(2-methylphenyl)-N-(pyridin-2-ylmethyl)propanediamide
CID 108947490
N-(3,4-difluorophenyl)-2-(pyridin-2-ylmethylamino)acetamide
CID 47107070
1-(3,4-dimethylphenyl)-2-(pyridin-2-ylmethylamino)ethanone
CID 82101270
N-(cyanomethyl)-2-(pyridin-2-ylmethylamino)acetamide
CID 28583464
N'-(2-amino-4-methylphenyl)-N-(pyridin-2-ylmethyl)oxamide
CID 108518419
5-(2,4-dimethylanilino)-N-(pyridin-2-ylmethyl)pyridine-2-carboxamide
CID 109190929
2-(cyclopropylmethylamino)-N-(2,4-dimethylphenyl)acetamide
CID 54924969

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethylphenyl)-2-(pyridin-2-ylmethylamino)acetamide?
The IUPAC name of N-(2,4-dimethylphenyl)-2-(pyridin-2-ylmethylamino)acetamide (CID 108999125) is N-(2,4-dimethylphenyl)-2-(pyridin-2-ylmethylamino)acetamide.
What is the SMILES notation for N-(2,4-dimethylphenyl)-2-(pyridin-2-ylmethylamino)acetamide?
The canonical SMILES for N-(2,4-dimethylphenyl)-2-(pyridin-2-ylmethylamino)acetamide is Cc1ccc(NC(=O)CNCc2ccccn2)c(C)c1.
What is the InChIKey of N-(2,4-dimethylphenyl)-2-(pyridin-2-ylmethylamino)acetamide?
The InChIKey is VDVYWCWQALFKHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O/c1-12-6-7-15(13(2)9-12)19-16(20)11-17-10-14-5-3-4-8-18-14/h3-9,17H,10-11H2,1-2H3,(H,19,20).
What are the key properties of N-(2,4-dimethylphenyl)-2-(pyridin-2-ylmethylamino)acetamide?
N-(2,4-dimethylphenyl)-2-(pyridin-2-ylmethylamino)acetamide has a molecular weight of 269.35 g/mol, XLogP of 2.43, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethylphenyl)-2-(pyridin-2-ylmethylamino)acetamide is sourced from PubChem (CID 108999125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).