N-[2,2-dimethyl-3-(methylamino)propyl]-2-pyridin-2-ylacetamide

C13H21N3O — CID 115271190

IUPACN-[2,2-dimethyl-3-(methylamino)propyl]-2-pyridin-2-ylacetamide
SMILESCNCC(C)(C)CNC(=O)Cc1ccccn1
InChIInChI=1S/C13H21N3O/c1-13(2,9-14-3)10-16-12(17)8-11-6-4-5-7-15-11/h4-7,14H,8-10H2,1-3H3,(H,16,17)
InChIKeyAUIDZZCFXIGVEJ-UHFFFAOYSA-N
MW235.33 g/mol
LogP0.99
Rot. Bonds6

About N-[2,2-dimethyl-3-(methylamino)propyl]-2-pyridin-2-ylacetamide

N-[2,2-dimethyl-3-(methylamino)propyl]-2-pyridin-2-ylacetamide (PubChem CID 115271190) has the molecular formula C13H21N3O and a molecular weight of 235.33 g/mol. Its IUPAC name is N-[2,2-dimethyl-3-(methylamino)propyl]-2-pyridin-2-ylacetamide.

Molecular Properties

Compound NameN-[2,2-dimethyl-3-(methylamino)propyl]-2-pyridin-2-ylacetamide
PubChem CID115271190
Molecular FormulaC13H21N3O
Molecular Weight235.33 g/mol
Exact Mass235.17
IUPAC NameN-[2,2-dimethyl-3-(methylamino)propyl]-2-pyridin-2-ylacetamide
SMILESCNCC(C)(C)CNC(=O)Cc1ccccn1
InChIInChI=1S/C13H21N3O/c1-13(2,9-14-3)10-16-12(17)8-11-6-4-5-7-15-11/h4-7,14H,8-10H2,1-3H3,(H,16,17)
InChIKeyAUIDZZCFXIGVEJ-UHFFFAOYSA-N
XLogP0.99
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 50.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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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-2-ylacetamide
CID 104931826
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
3-methyl-3-(methylamino)-1-pyridin-2-ylbutan-2-one
CID 116566539
N-[2,2-dimethyl-3-(methylamino)propyl]-2-phenoxyacetamide
CID 115267300
N-[2-(ethylamino)ethyl]-2-pyridin-2-ylacetamide
CID 62659164
N-[2-(propan-2-ylamino)ethyl]-2-pyridin-2-ylacetamide
CID 62658246
N-(3-hydroxy-2-methylpropyl)-2-pyridin-2-ylacetamide
CID 65037494
N-(2-hydroxy-2-methylpropyl)-3-pyridin-2-ylpropanamide
CID 79039378
N-(2-amino-2-methylpropyl)-3-pyridin-2-ylpropanamide
CID 81483427

Frequently Asked Questions

What is the IUPAC name of N-[2,2-dimethyl-3-(methylamino)propyl]-2-pyridin-2-ylacetamide?
The IUPAC name of N-[2,2-dimethyl-3-(methylamino)propyl]-2-pyridin-2-ylacetamide (CID 115271190) is N-[2,2-dimethyl-3-(methylamino)propyl]-2-pyridin-2-ylacetamide.
What is the SMILES notation for N-[2,2-dimethyl-3-(methylamino)propyl]-2-pyridin-2-ylacetamide?
The canonical SMILES for N-[2,2-dimethyl-3-(methylamino)propyl]-2-pyridin-2-ylacetamide is CNCC(C)(C)CNC(=O)Cc1ccccn1.
What is the InChIKey of N-[2,2-dimethyl-3-(methylamino)propyl]-2-pyridin-2-ylacetamide?
The InChIKey is AUIDZZCFXIGVEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O/c1-13(2,9-14-3)10-16-12(17)8-11-6-4-5-7-15-11/h4-7,14H,8-10H2,1-3H3,(H,16,17).
What are the key properties of N-[2,2-dimethyl-3-(methylamino)propyl]-2-pyridin-2-ylacetamide?
N-[2,2-dimethyl-3-(methylamino)propyl]-2-pyridin-2-ylacetamide has a molecular weight of 235.33 g/mol, XLogP of 0.99, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2,2-dimethyl-3-(methylamino)propyl]-2-pyridin-2-ylacetamide is sourced from PubChem (CID 115271190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).