2-(3,4-dimethoxyphenyl)-2-methyl-N-[2-(methylamino)propyl]propanamide

C16H26N2O3 — CID 120832492

IUPAC2-(3,4-dimethoxyphenyl)-2-methyl-N-[2-(methylamino)propyl]propanamide
SMILESCNC(C)CNC(=O)C(C)(C)c1ccc(OC)c(OC)c1
InChIInChI=1S/C16H26N2O3/c1-11(17-4)10-18-15(19)16(2,3)12-7-8-13(20-5)14(9-12)21-6/h7-9,11,17H,10H2,1-6H3,(H,18,19)
InChIKeyXNVULTDDHCJPRS-UHFFFAOYSA-N
MW294.40 g/mol
LogP1.71
Rot. Bonds7

About 2-(3,4-dimethoxyphenyl)-2-methyl-N-[2-(methylamino)propyl]propanamide

2-(3,4-dimethoxyphenyl)-2-methyl-N-[2-(methylamino)propyl]propanamide (PubChem CID 120832492) has the molecular formula C16H26N2O3 and a molecular weight of 294.40 g/mol. Its IUPAC name is 2-(3,4-dimethoxyphenyl)-2-methyl-N-[2-(methylamino)propyl]propanamide.

Molecular Properties

Compound Name2-(3,4-dimethoxyphenyl)-2-methyl-N-[2-(methylamino)propyl]propanamide
PubChem CID120832492
Molecular FormulaC16H26N2O3
Molecular Weight294.40 g/mol
Exact Mass294.19
IUPAC Name2-(3,4-dimethoxyphenyl)-2-methyl-N-[2-(methylamino)propyl]propanamide
SMILESCNC(C)CNC(=O)C(C)(C)c1ccc(OC)c(OC)c1
InChIInChI=1S/C16H26N2O3/c1-11(17-4)10-18-15(19)16(2,3)12-7-8-13(20-5)14(9-12)21-6/h7-9,11,17H,10H2,1-6H3,(H,18,19)
InChIKeyXNVULTDDHCJPRS-UHFFFAOYSA-N
XLogP1.71
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.40
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-butan-2-yl-2-(3,4-dimethoxyphenyl)-2-methylpropanamide
CID 110437705
N-(2-aminoethyl)-2-(3,4-dimethoxyphenyl)-2-methylpropanamide;hydrochloride
CID 119382877
3-[[2-(3,4-dimethoxyphenyl)-2-methylpropanoyl]amino]-2-methyl-2-phenylpropanoic acid
CID 120701535
2-[3-methoxy-4-(4-methylthiophen-3-yl)phenyl]-2-methyl-N-(2-methylpropyl)propanamide
CID 68774407
N-[4-(diethylamino)butyl]-2-(3,4-dimethoxyphenyl)-2-methylpropanamide
CID 110437749
2-(3,4-dimethoxyphenyl)-N-[(4-hydroxypyrrolidin-3-yl)methyl]-2-methylpropanamide
CID 120943522
2-(3,4-dimethoxyphenyl)-2-methyl-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)propanamide
CID 71853828
2-(3,4-dimethoxyphenyl)-N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-2-methylpropanamide
CID 71920570
2-(3,4-dimethoxyphenyl)-N-(2-methoxy-5-methylphenyl)-2-methylpropanamide
CID 110438702
N-(4-chlorophenyl)-2-(3,4-dimethoxyphenyl)-2-methylpropanamide
CID 110438694
N-(2-amino-1-cyclohexylethyl)-2-(3,4-dimethoxyphenyl)-2-methylpropanamide;hydrochloride
CID 119589762
2-(3,4-dimethoxyphenyl)-2-methyl-N-(3-piperazin-1-ylpropyl)propanamide
CID 119391625

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dimethoxyphenyl)-2-methyl-N-[2-(methylamino)propyl]propanamide?
The IUPAC name of 2-(3,4-dimethoxyphenyl)-2-methyl-N-[2-(methylamino)propyl]propanamide (CID 120832492) is 2-(3,4-dimethoxyphenyl)-2-methyl-N-[2-(methylamino)propyl]propanamide.
What is the SMILES notation for 2-(3,4-dimethoxyphenyl)-2-methyl-N-[2-(methylamino)propyl]propanamide?
The canonical SMILES for 2-(3,4-dimethoxyphenyl)-2-methyl-N-[2-(methylamino)propyl]propanamide is CNC(C)CNC(=O)C(C)(C)c1ccc(OC)c(OC)c1.
What is the InChIKey of 2-(3,4-dimethoxyphenyl)-2-methyl-N-[2-(methylamino)propyl]propanamide?
The InChIKey is XNVULTDDHCJPRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O3/c1-11(17-4)10-18-15(19)16(2,3)12-7-8-13(20-5)14(9-12)21-6/h7-9,11,17H,10H2,1-6H3,(H,18,19).
What are the key properties of 2-(3,4-dimethoxyphenyl)-2-methyl-N-[2-(methylamino)propyl]propanamide?
2-(3,4-dimethoxyphenyl)-2-methyl-N-[2-(methylamino)propyl]propanamide has a molecular weight of 294.40 g/mol, XLogP of 1.71, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dimethoxyphenyl)-2-methyl-N-[2-(methylamino)propyl]propanamide is sourced from PubChem (CID 120832492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).