N-(2-methylpropyl)-2-(1-propylpyrazol-4-yl)oxyacetamide

C12H21N3O2 — CID 116804964

IUPACN-(2-methylpropyl)-2-(1-propylpyrazol-4-yl)oxyacetamide
SMILESCCCn1cc(OCC(=O)NCC(C)C)cn1
InChIInChI=1S/C12H21N3O2/c1-4-5-15-8-11(7-14-15)17-9-12(16)13-6-10(2)3/h7-8,10H,4-6,9H2,1-3H3,(H,13,16)
InChIKeyFVXKRWJNZIHIAF-UHFFFAOYSA-N
MW239.32 g/mol
LogP1.44
Rot. Bonds7

About N-(2-methylpropyl)-2-(1-propylpyrazol-4-yl)oxyacetamide

N-(2-methylpropyl)-2-(1-propylpyrazol-4-yl)oxyacetamide (PubChem CID 116804964) has the molecular formula C12H21N3O2 and a molecular weight of 239.32 g/mol. Its IUPAC name is N-(2-methylpropyl)-2-(1-propylpyrazol-4-yl)oxyacetamide.

Molecular Properties

Compound NameN-(2-methylpropyl)-2-(1-propylpyrazol-4-yl)oxyacetamide
PubChem CID116804964
Molecular FormulaC12H21N3O2
Molecular Weight239.32 g/mol
Exact Mass239.16
IUPAC NameN-(2-methylpropyl)-2-(1-propylpyrazol-4-yl)oxyacetamide
SMILESCCCn1cc(OCC(=O)NCC(C)C)cn1
InChIInChI=1S/C12H21N3O2/c1-4-5-15-8-11(7-14-15)17-9-12(16)13-6-10(2)3/h7-8,10H,4-6,9H2,1-3H3,(H,13,16)
InChIKeyFVXKRWJNZIHIAF-UHFFFAOYSA-N
XLogP1.44
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(2-methylpropyl)-2-(1-propylpyrazol-4-yl)oxyacetamide 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-(1-ethylpyrazol-4-yl)oxy-N-propylacetamide
CID 116804713
N-(2-methylpropyl)-2-[4-(1-methylpyrazol-4-yl)phenoxy]acetamide
CID 119055389
N-(2-bromophenyl)-2-(1-propylpyrazol-4-yl)oxyacetamide
CID 116805188
2-methyl-N-propan-2-yl-3-(1-propylpyrazol-4-yl)oxypropan-1-amine
CID 103075179
N-ethyl-N-methyl-2-(1-propylpyrazol-4-yl)oxyacetamide
CID 116804991
N-(2-methoxyphenyl)-2-(1-propylpyrazol-4-yl)oxyacetamide
CID 116804913
N-(2-methylpropyl)-3-[(1-propylpyrazol-4-yl)methylamino]propanamide
CID 103571643
2-(1-ethylpyrazol-4-yl)oxy-N-pentan-3-ylacetamide
CID 116804587
4-propoxy-1-propylpyrazole
CID 116805185
3-methyl-2-(1-propylpyrazol-4-yl)oxybutanoic acid
CID 116799986
4-(1-propylpyrazol-4-yl)oxypentanehydrazide
CID 116804100
2-[1-(2-methylpropyl)pyrazol-4-yl]oxyacetic acid
CID 156587215

Frequently Asked Questions

What is the IUPAC name of N-(2-methylpropyl)-2-(1-propylpyrazol-4-yl)oxyacetamide?
The IUPAC name of N-(2-methylpropyl)-2-(1-propylpyrazol-4-yl)oxyacetamide (CID 116804964) is N-(2-methylpropyl)-2-(1-propylpyrazol-4-yl)oxyacetamide.
What is the SMILES notation for N-(2-methylpropyl)-2-(1-propylpyrazol-4-yl)oxyacetamide?
The canonical SMILES for N-(2-methylpropyl)-2-(1-propylpyrazol-4-yl)oxyacetamide is CCCn1cc(OCC(=O)NCC(C)C)cn1.
What is the InChIKey of N-(2-methylpropyl)-2-(1-propylpyrazol-4-yl)oxyacetamide?
The InChIKey is FVXKRWJNZIHIAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O2/c1-4-5-15-8-11(7-14-15)17-9-12(16)13-6-10(2)3/h7-8,10H,4-6,9H2,1-3H3,(H,13,16).
What are the key properties of N-(2-methylpropyl)-2-(1-propylpyrazol-4-yl)oxyacetamide?
N-(2-methylpropyl)-2-(1-propylpyrazol-4-yl)oxyacetamide has a molecular weight of 239.32 g/mol, XLogP of 1.44, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpropyl)-2-(1-propylpyrazol-4-yl)oxyacetamide is sourced from PubChem (CID 116804964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).