2-[[1-(4-methoxyphenyl)-1-oxopropan-2-yl]-methylamino]-N-propan-2-ylacetamide

C16H24N2O3 — CID 60681805

IUPAC2-[[1-(4-methoxyphenyl)-1-oxopropan-2-yl]-methylamino]-N-propan-2-ylacetamide
SMILESCOc1ccc(C(=O)C(C)N(C)CC(=O)NC(C)C)cc1
InChIInChI=1S/C16H24N2O3/c1-11(2)17-15(19)10-18(4)12(3)16(20)13-6-8-14(21-5)9-7-13/h6-9,11-12H,10H2,1-5H3,(H,17,19)
InChIKeyZHYKMGDSPPXVNT-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.72
Rot. Bonds7

About 2-[[1-(4-methoxyphenyl)-1-oxopropan-2-yl]-methylamino]-N-propan-2-ylacetamide

2-[[1-(4-methoxyphenyl)-1-oxopropan-2-yl]-methylamino]-N-propan-2-ylacetamide (PubChem CID 60681805) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is 2-[[1-(4-methoxyphenyl)-1-oxopropan-2-yl]-methylamino]-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-[[1-(4-methoxyphenyl)-1-oxopropan-2-yl]-methylamino]-N-propan-2-ylacetamide
PubChem CID60681805
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC Name2-[[1-(4-methoxyphenyl)-1-oxopropan-2-yl]-methylamino]-N-propan-2-ylacetamide
SMILESCOc1ccc(C(=O)C(C)N(C)CC(=O)NC(C)C)cc1
InChIInChI=1S/C16H24N2O3/c1-11(2)17-15(19)10-18(4)12(3)16(20)13-6-8-14(21-5)9-7-13/h6-9,11-12H,10H2,1-5H3,(H,17,19)
InChIKeyZHYKMGDSPPXVNT-UHFFFAOYSA-N
XLogP1.72
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(4-methoxyphenyl)ethyl]-2-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]propanamide
CID 24507139
N-ethyl-4-methoxy-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide
CID 47105894
2-[2-methoxyethyl(methyl)amino]-1-(4-methoxyphenyl)propan-1-one
CID 61427604
2-(4-methoxyphenyl)-N-propan-2-ylacetamide
CID 813075
2-(N-acetyl-4-methoxyanilino)-N-propan-2-ylacetamide
CID 113173486
1-(4-methoxyphenyl)-2-[methyl(2-pyrrolidin-1-ylethyl)amino]propan-1-one
CID 63207477
(2S)-1-(4-methoxyphenyl)-2-(methylamino)propan-1-one
CID 51371469
N-[1-(4-methoxyphenyl)propyl]-2-[methyl(propan-2-yl)amino]acetamide
CID 51252930
2-[[2-[(4-methoxyphenyl)methylamino]-2-oxoethyl]-methylamino]propanoic acid
CID 119912482
2-[(5-bromothiophen-3-yl)methyl-methylamino]-1-(4-methoxyphenyl)propan-1-one
CID 62037158
2-[ethyl-[1-(4-methoxyphenyl)-1-oxopropan-2-yl]amino]-N,N-dimethylacetamide
CID 62037090
2-[[2-[[2-(4-methoxyanilino)-2-oxoethyl]-methylamino]acetyl]amino]-N-propan-2-ylacetamide
CID 8818117

Frequently Asked Questions

What is the IUPAC name of 2-[[1-(4-methoxyphenyl)-1-oxopropan-2-yl]-methylamino]-N-propan-2-ylacetamide?
The IUPAC name of 2-[[1-(4-methoxyphenyl)-1-oxopropan-2-yl]-methylamino]-N-propan-2-ylacetamide (CID 60681805) is 2-[[1-(4-methoxyphenyl)-1-oxopropan-2-yl]-methylamino]-N-propan-2-ylacetamide.
What is the SMILES notation for 2-[[1-(4-methoxyphenyl)-1-oxopropan-2-yl]-methylamino]-N-propan-2-ylacetamide?
The canonical SMILES for 2-[[1-(4-methoxyphenyl)-1-oxopropan-2-yl]-methylamino]-N-propan-2-ylacetamide is COc1ccc(C(=O)C(C)N(C)CC(=O)NC(C)C)cc1.
What is the InChIKey of 2-[[1-(4-methoxyphenyl)-1-oxopropan-2-yl]-methylamino]-N-propan-2-ylacetamide?
The InChIKey is ZHYKMGDSPPXVNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3/c1-11(2)17-15(19)10-18(4)12(3)16(20)13-6-8-14(21-5)9-7-13/h6-9,11-12H,10H2,1-5H3,(H,17,19).
What are the key properties of 2-[[1-(4-methoxyphenyl)-1-oxopropan-2-yl]-methylamino]-N-propan-2-ylacetamide?
2-[[1-(4-methoxyphenyl)-1-oxopropan-2-yl]-methylamino]-N-propan-2-ylacetamide has a molecular weight of 292.38 g/mol, XLogP of 1.72, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[1-(4-methoxyphenyl)-1-oxopropan-2-yl]-methylamino]-N-propan-2-ylacetamide is sourced from PubChem (CID 60681805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).