N-(2-amino-3-methoxypropyl)-N-methyl-2-(4-methylphenyl)acetamide

C14H22N2O2 — CID 63754022

IUPACN-(2-amino-3-methoxypropyl)-N-methyl-2-(4-methylphenyl)acetamide
SMILESCOCC(N)CN(C)C(=O)Cc1ccc(C)cc1
InChIInChI=1S/C14H22N2O2/c1-11-4-6-12(7-5-11)8-14(17)16(2)9-13(15)10-18-3/h4-7,13H,8-10,15H2,1-3H3
InChIKeyUXVSPZDEFYLRKK-UHFFFAOYSA-N
MW250.34 g/mol
LogP0.97
Rot. Bonds6

About N-(2-amino-3-methoxypropyl)-N-methyl-2-(4-methylphenyl)acetamide

N-(2-amino-3-methoxypropyl)-N-methyl-2-(4-methylphenyl)acetamide (PubChem CID 63754022) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is N-(2-amino-3-methoxypropyl)-N-methyl-2-(4-methylphenyl)acetamide.

Molecular Properties

Compound NameN-(2-amino-3-methoxypropyl)-N-methyl-2-(4-methylphenyl)acetamide
PubChem CID63754022
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC NameN-(2-amino-3-methoxypropyl)-N-methyl-2-(4-methylphenyl)acetamide
SMILESCOCC(N)CN(C)C(=O)Cc1ccc(C)cc1
InChIInChI=1S/C14H22N2O2/c1-11-4-6-12(7-5-11)8-14(17)16(2)9-13(15)10-18-3/h4-7,13H,8-10,15H2,1-3H3
InChIKeyUXVSPZDEFYLRKK-UHFFFAOYSA-N
XLogP0.97
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 50.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(2-amino-3-methoxypropyl)-N-methyl-2-(4-methylphenyl)acetamide 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

N-(2-amino-3-methoxypropyl)-N,2-dimethylpropanamide
CID 63754189
N-(2-amino-3-methoxypropyl)-N-methyl-4-propan-2-ylbenzamide
CID 63754011
N-(2-amino-3-methoxypropyl)-N,3-dimethylbenzamide
CID 63753658
N-(2-amino-3-methoxypropyl)-N-methylbenzamide
CID 63753648
N,N-dimethyl-2-(4-methylphenyl)acetamide
CID 4048798
N-(2-hydroxypropyl)-2-(4-methoxyphenyl)-N-methylacetamide
CID 62333656
2-(4-aminophenyl)-N-methyl-N-[2-(4-methylphenoxy)ethyl]acetamide
CID 119695381
N-(2-amino-3-methoxypropyl)-N,6-dimethylpyridine-2-carboxamide
CID 63753834
2-(2,5-dimethylphenyl)-N-(2-hydroxy-3-methoxypropyl)-N-methylacetamide
CID 62539688
N-(2-amino-3-methoxypropyl)-N-methylheptanamide
CID 114754106
2,3-dimethoxypropyl 2-(4-methylphenyl)acetate
CID 166156189
N-(2-amino-3-methoxypropyl)-N-methylnaphthalene-2-carboxamide
CID 63754922

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-3-methoxypropyl)-N-methyl-2-(4-methylphenyl)acetamide?
The IUPAC name of N-(2-amino-3-methoxypropyl)-N-methyl-2-(4-methylphenyl)acetamide (CID 63754022) is N-(2-amino-3-methoxypropyl)-N-methyl-2-(4-methylphenyl)acetamide.
What is the SMILES notation for N-(2-amino-3-methoxypropyl)-N-methyl-2-(4-methylphenyl)acetamide?
The canonical SMILES for N-(2-amino-3-methoxypropyl)-N-methyl-2-(4-methylphenyl)acetamide is COCC(N)CN(C)C(=O)Cc1ccc(C)cc1.
What is the InChIKey of N-(2-amino-3-methoxypropyl)-N-methyl-2-(4-methylphenyl)acetamide?
The InChIKey is UXVSPZDEFYLRKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-11-4-6-12(7-5-11)8-14(17)16(2)9-13(15)10-18-3/h4-7,13H,8-10,15H2,1-3H3.
What are the key properties of N-(2-amino-3-methoxypropyl)-N-methyl-2-(4-methylphenyl)acetamide?
N-(2-amino-3-methoxypropyl)-N-methyl-2-(4-methylphenyl)acetamide has a molecular weight of 250.34 g/mol, XLogP of 0.97, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-3-methoxypropyl)-N-methyl-2-(4-methylphenyl)acetamide is sourced from PubChem (CID 63754022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).