2-(dimethylamino)-N-[(2-methylphenyl)methyl]-2-pyridin-3-ylacetamide

C17H21N3O — CID 110753901

IUPAC2-(dimethylamino)-N-[(2-methylphenyl)methyl]-2-pyridin-3-ylacetamide
SMILESCc1ccccc1CNC(=O)C(c1cccnc1)N(C)C
InChIInChI=1S/C17H21N3O/c1-13-7-4-5-8-14(13)12-19-17(21)16(20(2)3)15-9-6-10-18-11-15/h4-11,16H,12H2,1-3H3,(H,19,21)
InChIKeySIZDUCQZUVXHNC-UHFFFAOYSA-N
MW283.38 g/mol
LogP2.31
Rot. Bonds5

About 2-(dimethylamino)-N-[(2-methylphenyl)methyl]-2-pyridin-3-ylacetamide

2-(dimethylamino)-N-[(2-methylphenyl)methyl]-2-pyridin-3-ylacetamide (PubChem CID 110753901) has the molecular formula C17H21N3O and a molecular weight of 283.38 g/mol. Its IUPAC name is 2-(dimethylamino)-N-[(2-methylphenyl)methyl]-2-pyridin-3-ylacetamide.

Molecular Properties

Compound Name2-(dimethylamino)-N-[(2-methylphenyl)methyl]-2-pyridin-3-ylacetamide
PubChem CID110753901
Molecular FormulaC17H21N3O
Molecular Weight283.38 g/mol
Exact Mass283.17
IUPAC Name2-(dimethylamino)-N-[(2-methylphenyl)methyl]-2-pyridin-3-ylacetamide
SMILESCc1ccccc1CNC(=O)C(c1cccnc1)N(C)C
InChIInChI=1S/C17H21N3O/c1-13-7-4-5-8-14(13)12-19-17(21)16(20(2)3)15-9-6-10-18-11-15/h4-11,16H,12H2,1-3H3,(H,19,21)
InChIKeySIZDUCQZUVXHNC-UHFFFAOYSA-N
XLogP2.31
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.38
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

ethyl 2-[[2-(dimethylamino)-2-pyridin-3-ylacetyl]amino]benzoate
CID 110754063
2-(dimethylamino)-2-pyridin-3-ylacetamide;dihydrochloride
CID 67492420
(2R)-2-amino-N-[(3-methyl-4-pyridinyl)methyl]-2-phenylacetamide
CID 104941421
2-(4-tert-butyl-N-methylanilino)-2-pyridin-3-yl-N-(pyridin-2-ylmethyl)acetamide
CID 156893603
N-benzyl-2-(dimethylamino)-N-methyl-2-pyridin-3-ylacetamide
CID 110753905
(2R)-2-(diethylamino)-2-phenyl-N-(pyridin-3-ylmethyl)acetamide
CID 95151104
1-methyl-3-[(2-methylphenyl)methyl]-1-(1-phenylethyl)urea
CID 86914055
N-[(2-methylphenyl)methyl]-3-(pyridin-3-ylmethylamino)propanamide
CID 109019088
ethyl 4-[[2-(dimethylamino)-2-pyridin-3-ylacetyl]amino]piperidine-1-carboxylate
CID 110753942
N-methyl-3-(methylamino)-N-[(2-methylphenyl)methyl]pyridine-4-carboxamide
CID 105069435
3-(dimethylamino)-3-pyridin-3-ylpropanoic acid
CID 64526600
2-(dimethylamino)-2-(2-methylphenyl)-N-(pyrazolo[1,5-a]pyrimidin-3-ylmethyl)acetamide
CID 72841553

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-N-[(2-methylphenyl)methyl]-2-pyridin-3-ylacetamide?
The IUPAC name of 2-(dimethylamino)-N-[(2-methylphenyl)methyl]-2-pyridin-3-ylacetamide (CID 110753901) is 2-(dimethylamino)-N-[(2-methylphenyl)methyl]-2-pyridin-3-ylacetamide.
What is the SMILES notation for 2-(dimethylamino)-N-[(2-methylphenyl)methyl]-2-pyridin-3-ylacetamide?
The canonical SMILES for 2-(dimethylamino)-N-[(2-methylphenyl)methyl]-2-pyridin-3-ylacetamide is Cc1ccccc1CNC(=O)C(c1cccnc1)N(C)C.
What is the InChIKey of 2-(dimethylamino)-N-[(2-methylphenyl)methyl]-2-pyridin-3-ylacetamide?
The InChIKey is SIZDUCQZUVXHNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O/c1-13-7-4-5-8-14(13)12-19-17(21)16(20(2)3)15-9-6-10-18-11-15/h4-11,16H,12H2,1-3H3,(H,19,21).
What are the key properties of 2-(dimethylamino)-N-[(2-methylphenyl)methyl]-2-pyridin-3-ylacetamide?
2-(dimethylamino)-N-[(2-methylphenyl)methyl]-2-pyridin-3-ylacetamide has a molecular weight of 283.38 g/mol, XLogP of 2.31, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-N-[(2-methylphenyl)methyl]-2-pyridin-3-ylacetamide is sourced from PubChem (CID 110753901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).