N-propan-2-yl-2-[(2,3,4-trimethoxyphenyl)methylamino]acetamide

C15H24N2O4 — CID 43400025

IUPACN-propan-2-yl-2-[(2,3,4-trimethoxyphenyl)methylamino]acetamide
SMILESCOc1ccc(CNCC(=O)NC(C)C)c(OC)c1OC
InChIInChI=1S/C15H24N2O4/c1-10(2)17-13(18)9-16-8-11-6-7-12(19-3)15(21-5)14(11)20-4/h6-7,10,16H,8-9H2,1-5H3,(H,17,18)
InChIKeyMAIBXKOYPGCSKZ-UHFFFAOYSA-N
MW296.37 g/mol
LogP1.33
Rot. Bonds8

About N-propan-2-yl-2-[(2,3,4-trimethoxyphenyl)methylamino]acetamide

N-propan-2-yl-2-[(2,3,4-trimethoxyphenyl)methylamino]acetamide (PubChem CID 43400025) has the molecular formula C15H24N2O4 and a molecular weight of 296.37 g/mol. Its IUPAC name is N-propan-2-yl-2-[(2,3,4-trimethoxyphenyl)methylamino]acetamide.

Molecular Properties

Compound NameN-propan-2-yl-2-[(2,3,4-trimethoxyphenyl)methylamino]acetamide
PubChem CID43400025
Molecular FormulaC15H24N2O4
Molecular Weight296.37 g/mol
Exact Mass296.17
IUPAC NameN-propan-2-yl-2-[(2,3,4-trimethoxyphenyl)methylamino]acetamide
SMILESCOc1ccc(CNCC(=O)NC(C)C)c(OC)c1OC
InChIInChI=1S/C15H24N2O4/c1-10(2)17-13(18)9-16-8-11-6-7-12(19-3)15(21-5)14(11)20-4/h6-7,10,16H,8-9H2,1-5H3,(H,17,18)
InChIKeyMAIBXKOYPGCSKZ-UHFFFAOYSA-N
XLogP1.33
TPSA68.82 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 51.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-propan-2-yl-2-[(2,3,4-trimethoxyphenyl)methylamino]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

2-[(2,3-dimethoxyphenyl)methylamino]-N-propan-2-ylacetamide
CID 43400002
N-cyclopropyl-2-[(2,3,4-trimethoxyphenyl)methylamino]acetamide
CID 43430495
N,N-dimethyl-2-[(2,3,4-trimethoxyphenyl)methylamino]acetamide
CID 43214462
2-methyl-N-[(2,3,4-trimethoxyphenyl)methyl]propan-1-amine
CID 4719122
N-[(2,3,4-trimethoxyphenyl)methyl]acetamide
CID 18425632
N-pentan-2-yl-2-(2,3,4-trimethoxyphenyl)acetamide
CID 18089547
2-[(2-bromo-4,5-dimethoxyphenyl)methylamino]-N-propan-2-ylacetamide
CID 43224154
2-(cyclopropylmethylamino)-N-[(2,3,4-trimethoxyphenyl)methyl]acetamide;hydrochloride
CID 119716059
N-(1-thiophen-2-ylethyl)-2-(2,3,4-trimethoxyphenyl)acetamide
CID 18090212
N-(propan-2-ylcarbamoyl)-2-[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl]acetamide
CID 9127737
3-[(2,3,4-trimethoxyphenyl)methylamino]propanamide
CID 43553337
2-[(3,5-dibromo-2-methoxyphenyl)methylamino]-N-propan-2-ylacetamide
CID 43224145

Frequently Asked Questions

What is the IUPAC name of N-propan-2-yl-2-[(2,3,4-trimethoxyphenyl)methylamino]acetamide?
The IUPAC name of N-propan-2-yl-2-[(2,3,4-trimethoxyphenyl)methylamino]acetamide (CID 43400025) is N-propan-2-yl-2-[(2,3,4-trimethoxyphenyl)methylamino]acetamide.
What is the SMILES notation for N-propan-2-yl-2-[(2,3,4-trimethoxyphenyl)methylamino]acetamide?
The canonical SMILES for N-propan-2-yl-2-[(2,3,4-trimethoxyphenyl)methylamino]acetamide is COc1ccc(CNCC(=O)NC(C)C)c(OC)c1OC.
What is the InChIKey of N-propan-2-yl-2-[(2,3,4-trimethoxyphenyl)methylamino]acetamide?
The InChIKey is MAIBXKOYPGCSKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O4/c1-10(2)17-13(18)9-16-8-11-6-7-12(19-3)15(21-5)14(11)20-4/h6-7,10,16H,8-9H2,1-5H3,(H,17,18).
What are the key properties of N-propan-2-yl-2-[(2,3,4-trimethoxyphenyl)methylamino]acetamide?
N-propan-2-yl-2-[(2,3,4-trimethoxyphenyl)methylamino]acetamide has a molecular weight of 296.37 g/mol, XLogP of 1.33, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-yl-2-[(2,3,4-trimethoxyphenyl)methylamino]acetamide is sourced from PubChem (CID 43400025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).