N-[3-[2-(dimethylamino)ethoxy]phenyl]-2,2-dimethylpropanamide

C15H24N2O2 — CID 60776296

IUPACN-[3-[2-(dimethylamino)ethoxy]phenyl]-2,2-dimethylpropanamide
SMILESCN(C)CCOc1cccc(NC(=O)C(C)(C)C)c1
InChIInChI=1S/C15H24N2O2/c1-15(2,3)14(18)16-12-7-6-8-13(11-12)19-10-9-17(4)5/h6-8,11H,9-10H2,1-5H3,(H,16,18)
InChIKeyOHEGWJKTUVIQOU-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.61
Rot. Bonds5

About N-[3-[2-(dimethylamino)ethoxy]phenyl]-2,2-dimethylpropanamide

N-[3-[2-(dimethylamino)ethoxy]phenyl]-2,2-dimethylpropanamide (PubChem CID 60776296) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is N-[3-[2-(dimethylamino)ethoxy]phenyl]-2,2-dimethylpropanamide.

Molecular Properties

Compound NameN-[3-[2-(dimethylamino)ethoxy]phenyl]-2,2-dimethylpropanamide
PubChem CID60776296
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC NameN-[3-[2-(dimethylamino)ethoxy]phenyl]-2,2-dimethylpropanamide
SMILESCN(C)CCOc1cccc(NC(=O)C(C)(C)C)c1
InChIInChI=1S/C15H24N2O2/c1-15(2,3)14(18)16-12-7-6-8-13(11-12)19-10-9-17(4)5/h6-8,11H,9-10H2,1-5H3,(H,16,18)
InChIKeyOHEGWJKTUVIQOU-UHFFFAOYSA-N
XLogP2.61
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-amino-N-[3-[2-(dimethylamino)ethoxy]phenyl]-3,3-dimethylbutanamide
CID 61180242
2-amino-N-[3-[3-(dimethylamino)propoxy]phenyl]-2-phenylpropanamide
CID 120596891
N-[3-[2-(dimethylamino)ethoxy]phenyl]butanamide
CID 60776294
N-[3-[3-(dimethylamino)propoxy]phenyl]acetamide
CID 71811695
2,2,2-trifluoroethyl N-[3-[2-(dimethylamino)ethoxy]phenyl]carbamate
CID 65173309
N-[3-(2-amino-2-oxoethoxy)phenyl]-2,2-dimethylpropanamide
CID 38160075
2-amino-N-[3-[3-(dimethylamino)propoxy]phenyl]-2-methylpentanamide;dihydrochloride
CID 119885880
1-amino-N-[3-[2-(dimethylamino)ethoxy]phenyl]cyclopropane-1-carboxamide
CID 65464434
3-amino-4-[3-[2-(dimethylamino)ethoxy]anilino]-4-oxobutanoic acid
CID 64897056
2-(azetidin-3-yl)-N-[3-[2-(dimethylamino)ethoxy]phenyl]acetamide
CID 64618376
2-(butan-2-ylamino)-N-[3-[2-(dimethylamino)ethoxy]phenyl]acetamide
CID 60852855
1-[3-[2-(dimethylamino)ethoxy]phenyl]-4,4-dimethylpent-1-yn-3-one
CID 58408613

Frequently Asked Questions

What is the IUPAC name of N-[3-[2-(dimethylamino)ethoxy]phenyl]-2,2-dimethylpropanamide?
The IUPAC name of N-[3-[2-(dimethylamino)ethoxy]phenyl]-2,2-dimethylpropanamide (CID 60776296) is N-[3-[2-(dimethylamino)ethoxy]phenyl]-2,2-dimethylpropanamide.
What is the SMILES notation for N-[3-[2-(dimethylamino)ethoxy]phenyl]-2,2-dimethylpropanamide?
The canonical SMILES for N-[3-[2-(dimethylamino)ethoxy]phenyl]-2,2-dimethylpropanamide is CN(C)CCOc1cccc(NC(=O)C(C)(C)C)c1.
What is the InChIKey of N-[3-[2-(dimethylamino)ethoxy]phenyl]-2,2-dimethylpropanamide?
The InChIKey is OHEGWJKTUVIQOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-15(2,3)14(18)16-12-7-6-8-13(11-12)19-10-9-17(4)5/h6-8,11H,9-10H2,1-5H3,(H,16,18).
What are the key properties of N-[3-[2-(dimethylamino)ethoxy]phenyl]-2,2-dimethylpropanamide?
N-[3-[2-(dimethylamino)ethoxy]phenyl]-2,2-dimethylpropanamide has a molecular weight of 264.37 g/mol, XLogP of 2.61, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[2-(dimethylamino)ethoxy]phenyl]-2,2-dimethylpropanamide is sourced from PubChem (CID 60776296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).