N-[4-[2-(dimethylamino)-2-oxoethoxy]phenyl]-2-methylpentanamide

C16H24N2O3 — CID 134005594

IUPACN-[4-[2-(dimethylamino)-2-oxoethoxy]phenyl]-2-methylpentanamide
SMILESCCCC(C)C(=O)Nc1ccc(OCC(=O)N(C)C)cc1
InChIInChI=1S/C16H24N2O3/c1-5-6-12(2)16(20)17-13-7-9-14(10-8-13)21-11-15(19)18(3)4/h7-10,12H,5-6,11H2,1-4H3,(H,17,20)
InChIKeyGQXDSOSCKWADQX-UHFFFAOYSA-N
MW292.38 g/mol
LogP2.53
Rot. Bonds7

About N-[4-[2-(dimethylamino)-2-oxoethoxy]phenyl]-2-methylpentanamide

N-[4-[2-(dimethylamino)-2-oxoethoxy]phenyl]-2-methylpentanamide (PubChem CID 134005594) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is N-[4-[2-(dimethylamino)-2-oxoethoxy]phenyl]-2-methylpentanamide.

Molecular Properties

Compound NameN-[4-[2-(dimethylamino)-2-oxoethoxy]phenyl]-2-methylpentanamide
PubChem CID134005594
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC NameN-[4-[2-(dimethylamino)-2-oxoethoxy]phenyl]-2-methylpentanamide
SMILESCCCC(C)C(=O)Nc1ccc(OCC(=O)N(C)C)cc1
InChIInChI=1S/C16H24N2O3/c1-5-6-12(2)16(20)17-13-7-9-14(10-8-13)21-11-15(19)18(3)4/h7-10,12H,5-6,11H2,1-4H3,(H,17,20)
InChIKeyGQXDSOSCKWADQX-UHFFFAOYSA-N
XLogP2.53
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-[2-(dimethylamino)-2-oxoethoxy]phenyl]-2-methylpropanamide
CID 32943144
2-methyl-N-[4-(2,2,2-trifluoroethoxy)phenyl]pentanamide
CID 134026710
N-[4-(cyanomethoxy)phenyl]-2-methylpentanamide
CID 43242605
(2S)-N-(4-acetamidophenyl)-2-methylpentanamide
CID 670216
N-(4-hydroxyphenyl)-2-methylpentanamide
CID 43210200
N-[4-[2-(dimethylamino)-2-oxoethoxy]phenyl]-4-propan-2-ylbenzamide
CID 32943301
2-methyl-N-phenylpentanamide
CID 4627801
N-[1-[4-[2-(dimethylamino)-2-oxoethoxy]anilino]-3-methyl-1-oxobutan-2-yl]-4-methylbenzamide
CID 55587940
methyl 2-[4-[(3-chloro-2-methylpropanoyl)amino]phenoxy]acetate
CID 62729425
N-[4-[2-(dimethylamino)-2-oxoethoxy]phenyl]-3,3-dimethylbutanamide
CID 32943486
N-[4-[2-(dimethylamino)-2-oxoethoxy]phenyl]-4-methoxybenzamide
CID 32943268
N-[4-(bromomethyl)phenyl]-2-methylpentanamide
CID 114310848

Frequently Asked Questions

What is the IUPAC name of N-[4-[2-(dimethylamino)-2-oxoethoxy]phenyl]-2-methylpentanamide?
The IUPAC name of N-[4-[2-(dimethylamino)-2-oxoethoxy]phenyl]-2-methylpentanamide (CID 134005594) is N-[4-[2-(dimethylamino)-2-oxoethoxy]phenyl]-2-methylpentanamide.
What is the SMILES notation for N-[4-[2-(dimethylamino)-2-oxoethoxy]phenyl]-2-methylpentanamide?
The canonical SMILES for N-[4-[2-(dimethylamino)-2-oxoethoxy]phenyl]-2-methylpentanamide is CCCC(C)C(=O)Nc1ccc(OCC(=O)N(C)C)cc1.
What is the InChIKey of N-[4-[2-(dimethylamino)-2-oxoethoxy]phenyl]-2-methylpentanamide?
The InChIKey is GQXDSOSCKWADQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3/c1-5-6-12(2)16(20)17-13-7-9-14(10-8-13)21-11-15(19)18(3)4/h7-10,12H,5-6,11H2,1-4H3,(H,17,20).
What are the key properties of N-[4-[2-(dimethylamino)-2-oxoethoxy]phenyl]-2-methylpentanamide?
N-[4-[2-(dimethylamino)-2-oxoethoxy]phenyl]-2-methylpentanamide has a molecular weight of 292.38 g/mol, XLogP of 2.53, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[2-(dimethylamino)-2-oxoethoxy]phenyl]-2-methylpentanamide is sourced from PubChem (CID 134005594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).