2,2-dimethyl-N-[2-(methylamino)-2-pyridin-2-ylethyl]-N-phenylpropanamide

C19H25N3O — CID 22414373

IUPAC2,2-dimethyl-N-[2-(methylamino)-2-pyridin-2-ylethyl]-N-phenylpropanamide
SMILESCNC(CN(C(=O)C(C)(C)C)c1ccccc1)c1ccccn1
InChIInChI=1S/C19H25N3O/c1-19(2,3)18(23)22(15-10-6-5-7-11-15)14-17(20-4)16-12-8-9-13-21-16/h5-13,17,20H,14H2,1-4H3
InChIKeyHQVQCDXCKTYXDJ-UHFFFAOYSA-N
MW311.43 g/mol
LogP3.42
Rot. Bonds5

About 2,2-dimethyl-N-[2-(methylamino)-2-pyridin-2-ylethyl]-N-phenylpropanamide

2,2-dimethyl-N-[2-(methylamino)-2-pyridin-2-ylethyl]-N-phenylpropanamide (PubChem CID 22414373) has the molecular formula C19H25N3O and a molecular weight of 311.43 g/mol. Its IUPAC name is 2,2-dimethyl-N-[2-(methylamino)-2-pyridin-2-ylethyl]-N-phenylpropanamide.

Molecular Properties

Compound Name2,2-dimethyl-N-[2-(methylamino)-2-pyridin-2-ylethyl]-N-phenylpropanamide
PubChem CID22414373
Molecular FormulaC19H25N3O
Molecular Weight311.43 g/mol
Exact Mass311.20
IUPAC Name2,2-dimethyl-N-[2-(methylamino)-2-pyridin-2-ylethyl]-N-phenylpropanamide
SMILESCNC(CN(C(=O)C(C)(C)C)c1ccccc1)c1ccccn1
InChIInChI=1S/C19H25N3O/c1-19(2,3)18(23)22(15-10-6-5-7-11-15)14-17(20-4)16-12-8-9-13-21-16/h5-13,17,20H,14H2,1-4H3
InChIKeyHQVQCDXCKTYXDJ-UHFFFAOYSA-N
XLogP3.42
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.43
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-2,2-dimethyl-N-phenylpropanamide
CID 4127582
3,3-dimethyl-4-(methylamino)-4-pyridin-2-ylbutanoic acid
CID 116953575
N-ethyl-N,2-diphenyl-2-pyridin-2-ylacetamide
CID 110373393
N-tert-butyl-2-phenyl-2-pyridin-2-ylacetamide
CID 110373379
N-[2-[2-(methylamino)-2-pyridin-2-ylethyl]phenyl]acetamide
CID 54117111
N'-ethyl-N-methyl-1-pyridin-2-ylethane-1,2-diamine
CID 116950392
2,2-dimethyl-N-(2-phenyl-2-pyridin-2-ylethyl)propanamide
CID 16927739
(1R)-1-hydroxy-3,3-dimethyl-1-pyridin-2-ylbutan-2-one
CID 166005900
2,2-dimethyl-N-(1-pyridin-2-ylethyl)propanamide
CID 60629083
N-methyl-3-methylsulfanyl-1-pyridin-2-ylpropan-1-amine
CID 116831660
tert-butyl N-(2-hydroxy-1-pyridin-2-ylethyl)carbamate
CID 10728628
4-[methylamino(pyridin-2-yl)methyl]benzoic acid
CID 116953941

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-[2-(methylamino)-2-pyridin-2-ylethyl]-N-phenylpropanamide?
The IUPAC name of 2,2-dimethyl-N-[2-(methylamino)-2-pyridin-2-ylethyl]-N-phenylpropanamide (CID 22414373) is 2,2-dimethyl-N-[2-(methylamino)-2-pyridin-2-ylethyl]-N-phenylpropanamide.
What is the SMILES notation for 2,2-dimethyl-N-[2-(methylamino)-2-pyridin-2-ylethyl]-N-phenylpropanamide?
The canonical SMILES for 2,2-dimethyl-N-[2-(methylamino)-2-pyridin-2-ylethyl]-N-phenylpropanamide is CNC(CN(C(=O)C(C)(C)C)c1ccccc1)c1ccccn1.
What is the InChIKey of 2,2-dimethyl-N-[2-(methylamino)-2-pyridin-2-ylethyl]-N-phenylpropanamide?
The InChIKey is HQVQCDXCKTYXDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O/c1-19(2,3)18(23)22(15-10-6-5-7-11-15)14-17(20-4)16-12-8-9-13-21-16/h5-13,17,20H,14H2,1-4H3.
What are the key properties of 2,2-dimethyl-N-[2-(methylamino)-2-pyridin-2-ylethyl]-N-phenylpropanamide?
2,2-dimethyl-N-[2-(methylamino)-2-pyridin-2-ylethyl]-N-phenylpropanamide has a molecular weight of 311.43 g/mol, XLogP of 3.42, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-[2-(methylamino)-2-pyridin-2-ylethyl]-N-phenylpropanamide is sourced from PubChem (CID 22414373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).