2-amino-N-[[2-(dimethylamino)-3-pyridinyl]methyl]-2-phenylacetamide

C16H20N4O — CID 119850323

IUPAC2-amino-N-[[2-(dimethylamino)-3-pyridinyl]methyl]-2-phenylacetamide
SMILESCN(C)c1ncccc1CNC(=O)C(N)c1ccccc1
InChIInChI=1S/C16H20N4O/c1-20(2)15-13(9-6-10-18-15)11-19-16(21)14(17)12-7-4-3-5-8-12/h3-10,14H,11,17H2,1-2H3,(H,19,21)
InChIKeyCTTHUPJCGFTISV-UHFFFAOYSA-N
MW284.36 g/mol
LogP1.46
Rot. Bonds5

About 2-amino-N-[[2-(dimethylamino)-3-pyridinyl]methyl]-2-phenylacetamide

2-amino-N-[[2-(dimethylamino)-3-pyridinyl]methyl]-2-phenylacetamide (PubChem CID 119850323) has the molecular formula C16H20N4O and a molecular weight of 284.36 g/mol. Its IUPAC name is 2-amino-N-[[2-(dimethylamino)-3-pyridinyl]methyl]-2-phenylacetamide.

Molecular Properties

Compound Name2-amino-N-[[2-(dimethylamino)-3-pyridinyl]methyl]-2-phenylacetamide
PubChem CID119850323
Molecular FormulaC16H20N4O
Molecular Weight284.36 g/mol
Exact Mass284.16
IUPAC Name2-amino-N-[[2-(dimethylamino)-3-pyridinyl]methyl]-2-phenylacetamide
SMILESCN(C)c1ncccc1CNC(=O)C(N)c1ccccc1
InChIInChI=1S/C16H20N4O/c1-20(2)15-13(9-6-10-18-15)11-19-16(21)14(17)12-7-4-3-5-8-12/h3-10,14H,11,17H2,1-2H3,(H,19,21)
InChIKeyCTTHUPJCGFTISV-UHFFFAOYSA-N
XLogP1.46
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-N-[[2-(dimethylamino)-3-pyridinyl]methyl]-2-phenylbutanamide
CID 51658349
3-amino-N-[[2-(dimethylamino)-3-pyridinyl]methyl]-3-phenylpropanamide;dihydrochloride
CID 119953108
N-[[2-(dimethylamino)-3-pyridinyl]methyl]-3,3-diphenylpropanamide
CID 55692566
N-[[2-(dimethylamino)-3-pyridinyl]methyl]-2-phenoxypropanamide
CID 45243997
3-amino-N-[[2-(dimethylamino)-3-pyridinyl]methyl]butanamide;dihydrochloride
CID 119850372
2-amino-N-[(3-methyl-2-pyridinyl)methyl]-2-phenylacetamide
CID 63306151
(2R)-N-[[2-(dimethylamino)-3-pyridinyl]methyl]-2-ethoxypropanamide
CID 94775944
(2R)-2-amino-N-[(3-methyl-4-pyridinyl)methyl]-2-phenylacetamide
CID 104941421
4-amino-N-[[2-(dimethylamino)-3-pyridinyl]methyl]butanamide
CID 119850383
2-amino-N-ethyl-2-phenylacetamide
CID 22262703
1-benzyl-3-[[2-(dimethylamino)-3-pyridinyl]methyl]thiourea
CID 43076083
1-[[2-(dimethylamino)-3-pyridinyl]methyl]-3-[(2R)-1-hydroxypropan-2-yl]urea
CID 94029130

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[[2-(dimethylamino)-3-pyridinyl]methyl]-2-phenylacetamide?
The IUPAC name of 2-amino-N-[[2-(dimethylamino)-3-pyridinyl]methyl]-2-phenylacetamide (CID 119850323) is 2-amino-N-[[2-(dimethylamino)-3-pyridinyl]methyl]-2-phenylacetamide.
What is the SMILES notation for 2-amino-N-[[2-(dimethylamino)-3-pyridinyl]methyl]-2-phenylacetamide?
The canonical SMILES for 2-amino-N-[[2-(dimethylamino)-3-pyridinyl]methyl]-2-phenylacetamide is CN(C)c1ncccc1CNC(=O)C(N)c1ccccc1.
What is the InChIKey of 2-amino-N-[[2-(dimethylamino)-3-pyridinyl]methyl]-2-phenylacetamide?
The InChIKey is CTTHUPJCGFTISV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O/c1-20(2)15-13(9-6-10-18-15)11-19-16(21)14(17)12-7-4-3-5-8-12/h3-10,14H,11,17H2,1-2H3,(H,19,21).
What are the key properties of 2-amino-N-[[2-(dimethylamino)-3-pyridinyl]methyl]-2-phenylacetamide?
2-amino-N-[[2-(dimethylamino)-3-pyridinyl]methyl]-2-phenylacetamide has a molecular weight of 284.36 g/mol, XLogP of 1.46, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[[2-(dimethylamino)-3-pyridinyl]methyl]-2-phenylacetamide is sourced from PubChem (CID 119850323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).