N-(1-amino-2-methylpropan-2-yl)-3-(3,4-dimethoxyphenyl)propanamide

C15H24N2O3 — CID 82354510

IUPACN-(1-amino-2-methylpropan-2-yl)-3-(3,4-dimethoxyphenyl)propanamide
SMILESCOc1ccc(CCC(=O)NC(C)(C)CN)cc1OC
InChIInChI=1S/C15H24N2O3/c1-15(2,10-16)17-14(18)8-6-11-5-7-12(19-3)13(9-11)20-4/h5,7,9H,6,8,10,16H2,1-4H3,(H,17,18)
InChIKeyUTMULPNLGDGPPC-UHFFFAOYSA-N
MW280.37 g/mol
LogP1.49
Rot. Bonds7

About N-(1-amino-2-methylpropan-2-yl)-3-(3,4-dimethoxyphenyl)propanamide

N-(1-amino-2-methylpropan-2-yl)-3-(3,4-dimethoxyphenyl)propanamide (PubChem CID 82354510) has the molecular formula C15H24N2O3 and a molecular weight of 280.37 g/mol. Its IUPAC name is N-(1-amino-2-methylpropan-2-yl)-3-(3,4-dimethoxyphenyl)propanamide.

Molecular Properties

Compound NameN-(1-amino-2-methylpropan-2-yl)-3-(3,4-dimethoxyphenyl)propanamide
PubChem CID82354510
Molecular FormulaC15H24N2O3
Molecular Weight280.37 g/mol
Exact Mass280.18
IUPAC NameN-(1-amino-2-methylpropan-2-yl)-3-(3,4-dimethoxyphenyl)propanamide
SMILESCOc1ccc(CCC(=O)NC(C)(C)CN)cc1OC
InChIInChI=1S/C15H24N2O3/c1-15(2,10-16)17-14(18)8-6-11-5-7-12(19-3)13(9-11)20-4/h5,7,9H,6,8,10,16H2,1-4H3,(H,17,18)
InChIKeyUTMULPNLGDGPPC-UHFFFAOYSA-N
XLogP1.49
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 51.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(1-amino-2-methylpropan-2-yl)-3-(3,4-dimethoxyphenyl)propanamide 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

3-(3,4-dimethoxyphenyl)-N-(2-methylpentan-2-yl)propanamide
CID 49366734
N-(1-amino-2-methylpropan-2-yl)-3-(3,4,5-trimethoxyphenyl)propanamide
CID 119522297
N-(1-amino-2-methylpropan-2-yl)-3-(4-tert-butylphenyl)propanamide
CID 119522264
3-(3-fluoro-4-methoxyphenyl)-N-(1-hydroxy-2-methylpropan-2-yl)propanamide
CID 110001057
N-(3-aminopropyl)-3-(3,4-dimethoxyphenyl)propanamide
CID 28754050
N-[6-(tert-butylamino)pyridazin-3-yl]-3-(3,4-dimethoxyphenyl)propanamide
CID 113044288
3-(3,4-dimethoxyphenyl)propanamide;hydrochloride
CID 70371168
3-(3,4-dimethoxyphenyl)-N-propan-2-ylpropanamide
CID 19220709
N-(2-amino-2-ethylbutyl)-3-(3,4-dimethoxyphenyl)propanamide
CID 119643560
N-(4-aminocyclohexyl)-3-(3,4-dimethoxyphenyl)propanamide
CID 119478687
N-[2-[3-(3,4-dimethoxyphenyl)propanoylamino]ethyl]butanamide
CID 108574268
N-(1-amino-2-methylpropan-2-yl)-2-(2-methoxy-5-methylphenyl)acetamide
CID 110832873

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-2-methylpropan-2-yl)-3-(3,4-dimethoxyphenyl)propanamide?
The IUPAC name of N-(1-amino-2-methylpropan-2-yl)-3-(3,4-dimethoxyphenyl)propanamide (CID 82354510) is N-(1-amino-2-methylpropan-2-yl)-3-(3,4-dimethoxyphenyl)propanamide.
What is the SMILES notation for N-(1-amino-2-methylpropan-2-yl)-3-(3,4-dimethoxyphenyl)propanamide?
The canonical SMILES for N-(1-amino-2-methylpropan-2-yl)-3-(3,4-dimethoxyphenyl)propanamide is COc1ccc(CCC(=O)NC(C)(C)CN)cc1OC.
What is the InChIKey of N-(1-amino-2-methylpropan-2-yl)-3-(3,4-dimethoxyphenyl)propanamide?
The InChIKey is UTMULPNLGDGPPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O3/c1-15(2,10-16)17-14(18)8-6-11-5-7-12(19-3)13(9-11)20-4/h5,7,9H,6,8,10,16H2,1-4H3,(H,17,18).
What are the key properties of N-(1-amino-2-methylpropan-2-yl)-3-(3,4-dimethoxyphenyl)propanamide?
N-(1-amino-2-methylpropan-2-yl)-3-(3,4-dimethoxyphenyl)propanamide has a molecular weight of 280.37 g/mol, XLogP of 1.49, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-2-methylpropan-2-yl)-3-(3,4-dimethoxyphenyl)propanamide is sourced from PubChem (CID 82354510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).