N-[3-[(dimethylamino)methyl]phenyl]-2-methoxy-2-methylpropanamide

C14H22N2O2 — CID 113233308

IUPACN-[3-[(dimethylamino)methyl]phenyl]-2-methoxy-2-methylpropanamide
SMILESCOC(C)(C)C(=O)Nc1cccc(CN(C)C)c1
InChIInChI=1S/C14H22N2O2/c1-14(2,18-5)13(17)15-12-8-6-7-11(9-12)10-16(3)4/h6-9H,10H2,1-5H3,(H,15,17)
InChIKeyUIRLZHFBQUVOJN-UHFFFAOYSA-N
MW250.34 g/mol
LogP2.11
Rot. Bonds5

About N-[3-[(dimethylamino)methyl]phenyl]-2-methoxy-2-methylpropanamide

N-[3-[(dimethylamino)methyl]phenyl]-2-methoxy-2-methylpropanamide (PubChem CID 113233308) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is N-[3-[(dimethylamino)methyl]phenyl]-2-methoxy-2-methylpropanamide.

Molecular Properties

Compound NameN-[3-[(dimethylamino)methyl]phenyl]-2-methoxy-2-methylpropanamide
PubChem CID113233308
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC NameN-[3-[(dimethylamino)methyl]phenyl]-2-methoxy-2-methylpropanamide
SMILESCOC(C)(C)C(=O)Nc1cccc(CN(C)C)c1
InChIInChI=1S/C14H22N2O2/c1-14(2,18-5)13(17)15-12-8-6-7-11(9-12)10-16(3)4/h6-9H,10H2,1-5H3,(H,15,17)
InChIKeyUIRLZHFBQUVOJN-UHFFFAOYSA-N
XLogP2.11
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[3-[(dimethylamino)methyl]phenyl]-2-methoxy-2-methylpropanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-methoxy-2-methyl-N-[3-(methylaminomethyl)phenyl]propanamide
CID 103021373
methyl 4-[[3-[(dimethylamino)methyl]phenyl]carbamoyl]benzoate
CID 54326665
3-[3-[(dimethylamino)methyl]phenyl]-1-(2-hydroxy-2-methylpropyl)-1-methylurea
CID 111601451
4-[[3-[(dimethylamino)methyl]phenyl]carbamoyl]benzoic acid
CID 54173782
2-amino-N-[3-[(dimethylamino)methyl]phenyl]acetamide;dihydrochloride
CID 119853176
(2S)-2-amino-N-[3-[(dimethylamino)methyl]phenyl]propanamide
CID 61145682
3-[(dimethylamino)methyl]-N-(3-methoxy-3-methylbutan-2-yl)aniline
CID 114228156
3-chloro-N-[3-[(dimethylamino)methyl]phenyl]-2-methylpropanamide
CID 62727196
1-[3-[(dimethylamino)methyl]phenyl]-3-(2-hydroxypropyl)urea
CID 47202587
tert-butyl N-[[3-[[3-(2,2-dimethylpropanoylamino)benzoyl]amino]phenyl]methyl]-N-methylcarbamate
CID 55647789
3-(3-bromophenoxy)-N-[3-[(dimethylamino)methyl]phenyl]propanamide
CID 86931919
3-(chloromethyl)-N-[3-[(dimethylamino)methyl]phenyl]benzamide
CID 43697953

Frequently Asked Questions

What is the IUPAC name of N-[3-[(dimethylamino)methyl]phenyl]-2-methoxy-2-methylpropanamide?
The IUPAC name of N-[3-[(dimethylamino)methyl]phenyl]-2-methoxy-2-methylpropanamide (CID 113233308) is N-[3-[(dimethylamino)methyl]phenyl]-2-methoxy-2-methylpropanamide.
What is the SMILES notation for N-[3-[(dimethylamino)methyl]phenyl]-2-methoxy-2-methylpropanamide?
The canonical SMILES for N-[3-[(dimethylamino)methyl]phenyl]-2-methoxy-2-methylpropanamide is COC(C)(C)C(=O)Nc1cccc(CN(C)C)c1.
What is the InChIKey of N-[3-[(dimethylamino)methyl]phenyl]-2-methoxy-2-methylpropanamide?
The InChIKey is UIRLZHFBQUVOJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-14(2,18-5)13(17)15-12-8-6-7-11(9-12)10-16(3)4/h6-9H,10H2,1-5H3,(H,15,17).
What are the key properties of N-[3-[(dimethylamino)methyl]phenyl]-2-methoxy-2-methylpropanamide?
N-[3-[(dimethylamino)methyl]phenyl]-2-methoxy-2-methylpropanamide has a molecular weight of 250.34 g/mol, XLogP of 2.11, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(dimethylamino)methyl]phenyl]-2-methoxy-2-methylpropanamide is sourced from PubChem (CID 113233308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).