2-(5-amino-2-pyridinyl)-N-methyl-N-[1-(4-methylphenyl)ethyl]acetamide

C17H21N3O — CID 107337980

IUPAC2-(5-amino-2-pyridinyl)-N-methyl-N-[1-(4-methylphenyl)ethyl]acetamide
SMILESCc1ccc(C(C)N(C)C(=O)Cc2ccc(N)cn2)cc1
InChIInChI=1S/C17H21N3O/c1-12-4-6-14(7-5-12)13(2)20(3)17(21)10-16-9-8-15(18)11-19-16/h4-9,11,13H,10,18H2,1-3H3
InChIKeyOXLGSYZFXOCEBH-UHFFFAOYSA-N
MW283.38 g/mol
LogP2.73
Rot. Bonds4

About 2-(5-amino-2-pyridinyl)-N-methyl-N-[1-(4-methylphenyl)ethyl]acetamide

2-(5-amino-2-pyridinyl)-N-methyl-N-[1-(4-methylphenyl)ethyl]acetamide (PubChem CID 107337980) has the molecular formula C17H21N3O and a molecular weight of 283.38 g/mol. Its IUPAC name is 2-(5-amino-2-pyridinyl)-N-methyl-N-[1-(4-methylphenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-(5-amino-2-pyridinyl)-N-methyl-N-[1-(4-methylphenyl)ethyl]acetamide
PubChem CID107337980
Molecular FormulaC17H21N3O
Molecular Weight283.38 g/mol
Exact Mass283.17
IUPAC Name2-(5-amino-2-pyridinyl)-N-methyl-N-[1-(4-methylphenyl)ethyl]acetamide
SMILESCc1ccc(C(C)N(C)C(=O)Cc2ccc(N)cn2)cc1
InChIInChI=1S/C17H21N3O/c1-12-4-6-14(7-5-12)13(2)20(3)17(21)10-16-9-8-15(18)11-19-16/h4-9,11,13H,10,18H2,1-3H3
InChIKeyOXLGSYZFXOCEBH-UHFFFAOYSA-N
XLogP2.73
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.38
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(5-amino-2-pyridinyl)-N-[1-(4-fluorophenyl)ethyl]-N-methylacetamide
CID 107337947
2-(5-amino-2-pyridinyl)-N-methyl-N-(1-methylsulfanylpropan-2-yl)acetamide
CID 107339531
2-(5-amino-2-pyridinyl)-N-[1-(2,5-difluorophenyl)ethyl]-N-methylacetamide;hydrochloride
CID 120621646
2-(5-amino-2-pyridinyl)-N,N-diethylacetamide;hydrochloride
CID 120616165
1-(5-amino-2-pyridinyl)-3-(dimethylamino)butan-2-one
CID 158610916
2-(5-amino-2-pyridinyl)-N-ethyl-N-propan-2-ylacetamide;hydrochloride
CID 120620159
N-(2-amino-2-oxoethyl)-2-(5-amino-2-pyridinyl)-N-(2-methylpropyl)acetamide
CID 107338053
2-(5-amino-2-pyridinyl)-N-methyl-N-[(2-methylphenyl)methyl]acetamide;hydrochloride
CID 120617349
2-(5-amino-2-pyridinyl)-N-methyl-N-(2-methylphenyl)acetamide
CID 107338609
N,N-dimethyl-2-(5-propan-2-yl-2-pyridinyl)acetamide
CID 176600306
N-methyl-N-[1-(4-methylphenyl)ethyl]-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide
CID 134054242
2-(5-amino-2-pyridinyl)-N-methyl-N-(3,3,3-trifluoropropyl)acetamide
CID 107339049

Frequently Asked Questions

What is the IUPAC name of 2-(5-amino-2-pyridinyl)-N-methyl-N-[1-(4-methylphenyl)ethyl]acetamide?
The IUPAC name of 2-(5-amino-2-pyridinyl)-N-methyl-N-[1-(4-methylphenyl)ethyl]acetamide (CID 107337980) is 2-(5-amino-2-pyridinyl)-N-methyl-N-[1-(4-methylphenyl)ethyl]acetamide.
What is the SMILES notation for 2-(5-amino-2-pyridinyl)-N-methyl-N-[1-(4-methylphenyl)ethyl]acetamide?
The canonical SMILES for 2-(5-amino-2-pyridinyl)-N-methyl-N-[1-(4-methylphenyl)ethyl]acetamide is Cc1ccc(C(C)N(C)C(=O)Cc2ccc(N)cn2)cc1.
What is the InChIKey of 2-(5-amino-2-pyridinyl)-N-methyl-N-[1-(4-methylphenyl)ethyl]acetamide?
The InChIKey is OXLGSYZFXOCEBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O/c1-12-4-6-14(7-5-12)13(2)20(3)17(21)10-16-9-8-15(18)11-19-16/h4-9,11,13H,10,18H2,1-3H3.
What are the key properties of 2-(5-amino-2-pyridinyl)-N-methyl-N-[1-(4-methylphenyl)ethyl]acetamide?
2-(5-amino-2-pyridinyl)-N-methyl-N-[1-(4-methylphenyl)ethyl]acetamide has a molecular weight of 283.38 g/mol, XLogP of 2.73, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-amino-2-pyridinyl)-N-methyl-N-[1-(4-methylphenyl)ethyl]acetamide is sourced from PubChem (CID 107337980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).