N-(4-methoxyphenyl)-2-[methyl(propyl)amino]acetamide;propane

C16H28N2O2 — CID 145342078

IUPACN-(4-methoxyphenyl)-2-[methyl(propyl)amino]acetamide;propane
SMILESCCC.CCCN(C)CC(=O)Nc1ccc(OC)cc1
InChIInChI=1S/C13H20N2O2.C3H8/c1-4-9-15(2)10-13(16)14-11-5-7-12(17-3)8-6-11;1-3-2/h5-8H,4,9-10H2,1-3H3,(H,14,16);3H2,1-2H3
InChIKeyGZUHKBRYSZYIHP-UHFFFAOYSA-N
MW280.41 g/mol
LogP3.39
Rot. Bonds6

About N-(4-methoxyphenyl)-2-[methyl(propyl)amino]acetamide;propane

N-(4-methoxyphenyl)-2-[methyl(propyl)amino]acetamide;propane (PubChem CID 145342078) has the molecular formula C16H28N2O2 and a molecular weight of 280.41 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-2-[methyl(propyl)amino]acetamide;propane.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-2-[methyl(propyl)amino]acetamide;propane
PubChem CID145342078
Molecular FormulaC16H28N2O2
Molecular Weight280.41 g/mol
Exact Mass280.22
IUPAC NameN-(4-methoxyphenyl)-2-[methyl(propyl)amino]acetamide;propane
SMILESCCC.CCCN(C)CC(=O)Nc1ccc(OC)cc1
InChIInChI=1S/C13H20N2O2.C3H8/c1-4-9-15(2)10-13(16)14-11-5-7-12(17-3)8-6-11;1-3-2/h5-8H,4,9-10H2,1-3H3,(H,14,16);3H2,1-2H3
InChIKeyGZUHKBRYSZYIHP-UHFFFAOYSA-N
XLogP3.39
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.41
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(dipropylamino)-N-(4-methoxyphenyl)acetamide
CID 54817180
N-(4-methoxyphenyl)-2-[methyl(2-methylpropyl)amino]acetamide
CID 167278425
N-(4-methoxyphenyl)-2-[methyl(2-pyridin-2-ylethyl)amino]acetamide
CID 17408677
N-(2,4-dimethoxyphenyl)-2-[methyl(propyl)amino]acetamide
CID 47085287
2-[(4-bromophenyl)methyl-methylamino]-N-(4-methoxyphenyl)acetamide
CID 2657324
N-(4-ethoxyphenyl)-2-[2-hydroxyethyl(methyl)amino]acetamide
CID 60683543
N-[4-[(E)-(5-methoxy-3-oxo-1H-inden-2-ylidene)methyl]phenyl]-2-[methyl(propyl)amino]acetamide
CID 166642387
3-(4-methoxyphenyl)-1,1-dipropylurea
CID 3574765
2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]-N-(4-methoxyphenyl)acetamide
CID 9053961
N-(4-cyanophenyl)-2-[(4-methoxyphenyl)methyl-methylamino]acetamide
CID 8761634
2-[(2-hydroxycyclopentyl)methyl-methylamino]-N-(4-methoxyphenyl)acetamide
CID 109397914
2-[2-(4-chlorophenyl)sulfonylethyl-methylamino]-N-(4-methoxyphenyl)acetamide
CID 17496506

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-2-[methyl(propyl)amino]acetamide;propane?
The IUPAC name of N-(4-methoxyphenyl)-2-[methyl(propyl)amino]acetamide;propane (CID 145342078) is N-(4-methoxyphenyl)-2-[methyl(propyl)amino]acetamide;propane.
What is the SMILES notation for N-(4-methoxyphenyl)-2-[methyl(propyl)amino]acetamide;propane?
The canonical SMILES for N-(4-methoxyphenyl)-2-[methyl(propyl)amino]acetamide;propane is CCC.CCCN(C)CC(=O)Nc1ccc(OC)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-2-[methyl(propyl)amino]acetamide;propane?
The InChIKey is GZUHKBRYSZYIHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2.C3H8/c1-4-9-15(2)10-13(16)14-11-5-7-12(17-3)8-6-11;1-3-2/h5-8H,4,9-10H2,1-3H3,(H,14,16);3H2,1-2H3.
What are the key properties of N-(4-methoxyphenyl)-2-[methyl(propyl)amino]acetamide;propane?
N-(4-methoxyphenyl)-2-[methyl(propyl)amino]acetamide;propane has a molecular weight of 280.41 g/mol, XLogP of 3.39, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-2-[methyl(propyl)amino]acetamide;propane is sourced from PubChem (CID 145342078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).