N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-pyridin-2-ylacetamide

C13H21N3O2 — CID 104931826

IUPACN-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-pyridin-2-ylacetamide
SMILESCN(C)CC(C)(O)CNC(=O)Cc1ccccn1
InChIInChI=1S/C13H21N3O2/c1-13(18,10-16(2)3)9-15-12(17)8-11-6-4-5-7-14-11/h4-7,18H,8-10H2,1-3H3,(H,15,17)
InChIKeyHTZAXSJKJUOZLE-UHFFFAOYSA-N
MW251.33 g/mol
LogP0.05
Rot. Bonds6

About N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-pyridin-2-ylacetamide

N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-pyridin-2-ylacetamide (PubChem CID 104931826) has the molecular formula C13H21N3O2 and a molecular weight of 251.33 g/mol. Its IUPAC name is N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-pyridin-2-ylacetamide.

Molecular Properties

Compound NameN-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-pyridin-2-ylacetamide
PubChem CID104931826
Molecular FormulaC13H21N3O2
Molecular Weight251.33 g/mol
Exact Mass251.16
IUPAC NameN-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-pyridin-2-ylacetamide
SMILESCN(C)CC(C)(O)CNC(=O)Cc1ccccn1
InChIInChI=1S/C13H21N3O2/c1-13(18,10-16(2)3)9-15-12(17)8-11-6-4-5-7-14-11/h4-7,18H,8-10H2,1-3H3,(H,15,17)
InChIKeyHTZAXSJKJUOZLE-UHFFFAOYSA-N
XLogP0.05
TPSA65.46 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 50.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-hydroxy-3-methyl-4-[(2-pyridin-2-ylacetyl)amino]butanoic acid
CID 66001150
N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-pyridin-4-ylacetamide
CID 103960990
N-[2,2-dimethyl-3-(methylamino)propyl]-2-pyridin-2-ylacetamide
CID 115271190
N-[2-[[3-(dimethylamino)-2-hydroxy-2-methylpropyl]amino]-2-oxoethyl]benzamide
CID 103839771
N-[2-ethyl-2-(hydroxymethyl)butyl]-2-pyridin-2-ylacetamide
CID 106252214
N-(2,2-difluoro-3-hydroxypropyl)-2-pyridin-2-ylacetamide
CID 106168483
ethyl 2-[(2-pyridin-2-ylacetyl)amino]acetate
CID 55026375
2-chloro-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-5-pyridin-2-ylbenzamide
CID 109399583
N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-(2-methylphenoxy)acetamide
CID 103839647
N-(2-hydroxy-2-methylpropyl)-3-pyridin-2-ylpropanamide
CID 79039378
2-chloro-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]benzamide
CID 103840160
N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-3-(2-methylphenoxy)propanamide
CID 103839511

Frequently Asked Questions

What is the IUPAC name of N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-pyridin-2-ylacetamide?
The IUPAC name of N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-pyridin-2-ylacetamide (CID 104931826) is N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-pyridin-2-ylacetamide.
What is the SMILES notation for N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-pyridin-2-ylacetamide?
The canonical SMILES for N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-pyridin-2-ylacetamide is CN(C)CC(C)(O)CNC(=O)Cc1ccccn1.
What is the InChIKey of N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-pyridin-2-ylacetamide?
The InChIKey is HTZAXSJKJUOZLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O2/c1-13(18,10-16(2)3)9-15-12(17)8-11-6-4-5-7-14-11/h4-7,18H,8-10H2,1-3H3,(H,15,17).
What are the key properties of N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-pyridin-2-ylacetamide?
N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-pyridin-2-ylacetamide has a molecular weight of 251.33 g/mol, XLogP of 0.05, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-pyridin-2-ylacetamide is sourced from PubChem (CID 104931826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).