N-[(2-methoxyphenyl)methyl]-2-methyl-2-(methylamino)propanamide

C13H20N2O2 — CID 62834293

IUPACN-[(2-methoxyphenyl)methyl]-2-methyl-2-(methylamino)propanamide
SMILESCNC(C)(C)C(=O)NCc1ccccc1OC
InChIInChI=1S/C13H20N2O2/c1-13(2,14-3)12(16)15-9-10-7-5-6-8-11(10)17-4/h5-8,14H,9H2,1-4H3,(H,15,16)
InChIKeyVAQHKXJEWHGJRR-UHFFFAOYSA-N
MW236.31 g/mol
LogP1.31
Rot. Bonds5

About N-[(2-methoxyphenyl)methyl]-2-methyl-2-(methylamino)propanamide

N-[(2-methoxyphenyl)methyl]-2-methyl-2-(methylamino)propanamide (PubChem CID 62834293) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is N-[(2-methoxyphenyl)methyl]-2-methyl-2-(methylamino)propanamide.

Molecular Properties

Compound NameN-[(2-methoxyphenyl)methyl]-2-methyl-2-(methylamino)propanamide
PubChem CID62834293
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC NameN-[(2-methoxyphenyl)methyl]-2-methyl-2-(methylamino)propanamide
SMILESCNC(C)(C)C(=O)NCc1ccccc1OC
InChIInChI=1S/C13H20N2O2/c1-13(2,14-3)12(16)15-9-10-7-5-6-8-11(10)17-4/h5-8,14H,9H2,1-4H3,(H,15,16)
InChIKeyVAQHKXJEWHGJRR-UHFFFAOYSA-N
XLogP1.31
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 51.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(5-bromo-2-methoxyphenyl)methyl]-2-methyl-2-(methylamino)propanamide
CID 115165713
2-amino-2-cyclopropyl-N-[(2-methoxyphenyl)methyl]propanamide
CID 54925372
tert-butyl N-[(2-methoxyphenyl)methyl]carbamate;hydrochloride
CID 174676513
2-hydroxy-N-[(2-methoxyphenyl)methyl]-2-methyl-3-phenylbutanamide
CID 122144681
4-tert-butyl-N-[(2-methoxyphenyl)methyl]benzamide
CID 795553
2-(tert-butylamino)-N-[(2-methoxyphenyl)methyl]acetamide
CID 78907392
1-ethyl-3-[(2-methoxyphenyl)methyl]urea
CID 38151032
1-(2-hydroxy-3,3-dimethylbutyl)-3-[(2-methoxyphenyl)methyl]urea
CID 111119483
2,2-dimethyl-N-[[2-[(2-methylpropan-2-yl)oxy]phenyl]methyl]propanamide
CID 110444704
(2S)-2-chloro-N-[(2-methoxyphenyl)methyl]propanamide
CID 9291152
2-anilino-N-[(2-methoxyphenyl)methyl]acetamide
CID 60646954
N-(2-ethyl-6-methylphenyl)-N'-[(2-methoxyphenyl)methyl]-2,2-dimethylpropanediamide
CID 108962937

Frequently Asked Questions

What is the IUPAC name of N-[(2-methoxyphenyl)methyl]-2-methyl-2-(methylamino)propanamide?
The IUPAC name of N-[(2-methoxyphenyl)methyl]-2-methyl-2-(methylamino)propanamide (CID 62834293) is N-[(2-methoxyphenyl)methyl]-2-methyl-2-(methylamino)propanamide.
What is the SMILES notation for N-[(2-methoxyphenyl)methyl]-2-methyl-2-(methylamino)propanamide?
The canonical SMILES for N-[(2-methoxyphenyl)methyl]-2-methyl-2-(methylamino)propanamide is CNC(C)(C)C(=O)NCc1ccccc1OC.
What is the InChIKey of N-[(2-methoxyphenyl)methyl]-2-methyl-2-(methylamino)propanamide?
The InChIKey is VAQHKXJEWHGJRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-13(2,14-3)12(16)15-9-10-7-5-6-8-11(10)17-4/h5-8,14H,9H2,1-4H3,(H,15,16).
What are the key properties of N-[(2-methoxyphenyl)methyl]-2-methyl-2-(methylamino)propanamide?
N-[(2-methoxyphenyl)methyl]-2-methyl-2-(methylamino)propanamide has a molecular weight of 236.31 g/mol, XLogP of 1.31, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methoxyphenyl)methyl]-2-methyl-2-(methylamino)propanamide is sourced from PubChem (CID 62834293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).