2-(dimethylamino)-N-[4-[(2-methylpropan-2-yl)oxy]-3-pyridinyl]acetamide

C13H21N3O2 — CID 86805213

IUPAC2-(dimethylamino)-N-[4-[(2-methylpropan-2-yl)oxy]-3-pyridinyl]acetamide
SMILESCN(C)CC(=O)Nc1cnccc1OC(C)(C)C
InChIInChI=1S/C13H21N3O2/c1-13(2,3)18-11-6-7-14-8-10(11)15-12(17)9-16(4)5/h6-8H,9H2,1-5H3,(H,15,17)
InChIKeyTVHYCRREZPHZBR-UHFFFAOYSA-N
MW251.33 g/mol
LogP1.76
Rot. Bonds4

About 2-(dimethylamino)-N-[4-[(2-methylpropan-2-yl)oxy]-3-pyridinyl]acetamide

2-(dimethylamino)-N-[4-[(2-methylpropan-2-yl)oxy]-3-pyridinyl]acetamide (PubChem CID 86805213) has the molecular formula C13H21N3O2 and a molecular weight of 251.33 g/mol. Its IUPAC name is 2-(dimethylamino)-N-[4-[(2-methylpropan-2-yl)oxy]-3-pyridinyl]acetamide.

Molecular Properties

Compound Name2-(dimethylamino)-N-[4-[(2-methylpropan-2-yl)oxy]-3-pyridinyl]acetamide
PubChem CID86805213
Molecular FormulaC13H21N3O2
Molecular Weight251.33 g/mol
Exact Mass251.16
IUPAC Name2-(dimethylamino)-N-[4-[(2-methylpropan-2-yl)oxy]-3-pyridinyl]acetamide
SMILESCN(C)CC(=O)Nc1cnccc1OC(C)(C)C
InChIInChI=1S/C13H21N3O2/c1-13(2,3)18-11-6-7-14-8-10(11)15-12(17)9-16(4)5/h6-8H,9H2,1-5H3,(H,15,17)
InChIKeyTVHYCRREZPHZBR-UHFFFAOYSA-N
XLogP1.76
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(dimethylamino)-N-[4-[(2-methylpropan-2-yl)oxy]-3-pyridinyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-N-[4-[(2-methylpropan-2-yl)oxy]-3-pyridinyl]acetamide?
The IUPAC name of 2-(dimethylamino)-N-[4-[(2-methylpropan-2-yl)oxy]-3-pyridinyl]acetamide (CID 86805213) is 2-(dimethylamino)-N-[4-[(2-methylpropan-2-yl)oxy]-3-pyridinyl]acetamide.
What is the SMILES notation for 2-(dimethylamino)-N-[4-[(2-methylpropan-2-yl)oxy]-3-pyridinyl]acetamide?
The canonical SMILES for 2-(dimethylamino)-N-[4-[(2-methylpropan-2-yl)oxy]-3-pyridinyl]acetamide is CN(C)CC(=O)Nc1cnccc1OC(C)(C)C.
What is the InChIKey of 2-(dimethylamino)-N-[4-[(2-methylpropan-2-yl)oxy]-3-pyridinyl]acetamide?
The InChIKey is TVHYCRREZPHZBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O2/c1-13(2,3)18-11-6-7-14-8-10(11)15-12(17)9-16(4)5/h6-8H,9H2,1-5H3,(H,15,17).
What are the key properties of 2-(dimethylamino)-N-[4-[(2-methylpropan-2-yl)oxy]-3-pyridinyl]acetamide?
2-(dimethylamino)-N-[4-[(2-methylpropan-2-yl)oxy]-3-pyridinyl]acetamide has a molecular weight of 251.33 g/mol, XLogP of 1.76, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-N-[4-[(2-methylpropan-2-yl)oxy]-3-pyridinyl]acetamide is sourced from PubChem (CID 86805213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).