N-[(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)methyl]-2-[2-methoxyethyl(methyl)amino]acetamide

C15H28N4O2 — CID 118774020

IUPACN-[(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)methyl]-2-[2-methoxyethyl(methyl)amino]acetamide
SMILESCOCCN(C)CC(=O)NCc1c(C)nn(C(C)C)c1C
InChIInChI=1S/C15H28N4O2/c1-11(2)19-13(4)14(12(3)17-19)9-16-15(20)10-18(5)7-8-21-6/h11H,7-10H2,1-6H3,(H,16,20)
InChIKeyYYHYOUDBCWWNSH-UHFFFAOYSA-N
MW296.42 g/mol
LogP1.28
Rot. Bonds8

About N-[(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)methyl]-2-[2-methoxyethyl(methyl)amino]acetamide

N-[(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)methyl]-2-[2-methoxyethyl(methyl)amino]acetamide (PubChem CID 118774020) has the molecular formula C15H28N4O2 and a molecular weight of 296.42 g/mol. Its IUPAC name is N-[(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)methyl]-2-[2-methoxyethyl(methyl)amino]acetamide.

Molecular Properties

Compound NameN-[(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)methyl]-2-[2-methoxyethyl(methyl)amino]acetamide
PubChem CID118774020
Molecular FormulaC15H28N4O2
Molecular Weight296.42 g/mol
Exact Mass296.22
IUPAC NameN-[(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)methyl]-2-[2-methoxyethyl(methyl)amino]acetamide
SMILESCOCCN(C)CC(=O)NCc1c(C)nn(C(C)C)c1C
InChIInChI=1S/C15H28N4O2/c1-11(2)19-13(4)14(12(3)17-19)9-16-15(20)10-18(5)7-8-21-6/h11H,7-10H2,1-6H3,(H,16,20)
InChIKeyYYHYOUDBCWWNSH-UHFFFAOYSA-N
XLogP1.28
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.42
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)methyl]-2-[2-methoxyethyl(methyl)amino]acetamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)methyl]-2-[2-methoxyethyl(methyl)amino]acetamide?
The IUPAC name of N-[(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)methyl]-2-[2-methoxyethyl(methyl)amino]acetamide (CID 118774020) is N-[(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)methyl]-2-[2-methoxyethyl(methyl)amino]acetamide.
What is the SMILES notation for N-[(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)methyl]-2-[2-methoxyethyl(methyl)amino]acetamide?
The canonical SMILES for N-[(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)methyl]-2-[2-methoxyethyl(methyl)amino]acetamide is COCCN(C)CC(=O)NCc1c(C)nn(C(C)C)c1C.
What is the InChIKey of N-[(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)methyl]-2-[2-methoxyethyl(methyl)amino]acetamide?
The InChIKey is YYHYOUDBCWWNSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N4O2/c1-11(2)19-13(4)14(12(3)17-19)9-16-15(20)10-18(5)7-8-21-6/h11H,7-10H2,1-6H3,(H,16,20).
What are the key properties of N-[(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)methyl]-2-[2-methoxyethyl(methyl)amino]acetamide?
N-[(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)methyl]-2-[2-methoxyethyl(methyl)amino]acetamide has a molecular weight of 296.42 g/mol, XLogP of 1.28, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)methyl]-2-[2-methoxyethyl(methyl)amino]acetamide is sourced from PubChem (CID 118774020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).