2-(4-aminopyrazol-1-yl)-N-(2-oxo-3H-1,3-benzoxazol-7-yl)acetamide

C12H11N5O3 — CID 155962162

IUPAC2-(4-aminopyrazol-1-yl)-N-(2-oxo-3H-1,3-benzoxazol-7-yl)acetamide
SMILESNc1cnn(CC(=O)Nc2cccc3[nH]c(=O)oc23)c1
InChIInChI=1S/C12H11N5O3/c13-7-4-14-17(5-7)6-10(18)15-8-2-1-3-9-11(8)20-12(19)16-9/h1-5H,6,13H2,(H,15,18)(H,16,19)
InChIKeyVOZVKOVLZJEDNU-UHFFFAOYSA-N
MW273.25 g/mol
LogP0.54
Rot. Bonds3

About 2-(4-aminopyrazol-1-yl)-N-(2-oxo-3H-1,3-benzoxazol-7-yl)acetamide

2-(4-aminopyrazol-1-yl)-N-(2-oxo-3H-1,3-benzoxazol-7-yl)acetamide (PubChem CID 155962162) has the molecular formula C12H11N5O3 and a molecular weight of 273.25 g/mol. Its IUPAC name is 2-(4-aminopyrazol-1-yl)-N-(2-oxo-3H-1,3-benzoxazol-7-yl)acetamide.

Molecular Properties

Compound Name2-(4-aminopyrazol-1-yl)-N-(2-oxo-3H-1,3-benzoxazol-7-yl)acetamide
PubChem CID155962162
Molecular FormulaC12H11N5O3
Molecular Weight273.25 g/mol
Exact Mass273.09
IUPAC Name2-(4-aminopyrazol-1-yl)-N-(2-oxo-3H-1,3-benzoxazol-7-yl)acetamide
SMILESNc1cnn(CC(=O)Nc2cccc3[nH]c(=O)oc23)c1
InChIInChI=1S/C12H11N5O3/c13-7-4-14-17(5-7)6-10(18)15-8-2-1-3-9-11(8)20-12(19)16-9/h1-5H,6,13H2,(H,15,18)(H,16,19)
InChIKeyVOZVKOVLZJEDNU-UHFFFAOYSA-N
XLogP0.54
TPSA118.94 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.25
LogP ≤ 50.54
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze 2-(4-aminopyrazol-1-yl)-N-(2-oxo-3H-1,3-benzoxazol-7-yl)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-[4-(dimethylcarbamoylamino)triazol-1-yl]-N-(2-oxo-3H-1,3-benzoxazol-7-yl)acetamide
CID 112522829
N-(2-oxo-3H-1,3-benzoxazol-7-yl)-2-(1H-pyrazol-5-yl)acetamide
CID 112522739
2-(4-aminopyrazol-1-yl)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide
CID 61117825
2-(4-aminopyrazol-1-yl)-N-(2,6-diethylphenyl)acetamide
CID 43445291
2-(4-aminopyrazol-1-yl)-N-(3-bromoquinolin-8-yl)acetamide
CID 116782974
2-(4-aminopyrazol-1-yl)-N-(2,5-dichlorophenyl)acetamide
CID 43382443
2-(4-aminopyrazol-1-yl)-N-[4-bromo-2-(trifluoromethyl)phenyl]acetamide
CID 60790791
2-(4-aminopyrazol-1-yl)-N-naphthalen-2-ylacetamide
CID 61118519
2-(4-aminopyrazol-1-yl)-N-(2-bromo-4-chlorophenyl)acetamide
CID 81262636
2-(4-aminopyrazol-1-yl)-N-(2,5-dimethoxyphenyl)acetamide
CID 43445334
2-(4-aminopyrazol-1-yl)-N-benzylacetamide
CID 28973852
N-(2-oxo-3H-1,3-benzoxazol-7-yl)-2-[4-(trifluoromethyl)phenyl]acetamide;2-[4-(trifluoromethyl)phenyl]acetic acid
CID 159954292

Frequently Asked Questions

What is the IUPAC name of 2-(4-aminopyrazol-1-yl)-N-(2-oxo-3H-1,3-benzoxazol-7-yl)acetamide?
The IUPAC name of 2-(4-aminopyrazol-1-yl)-N-(2-oxo-3H-1,3-benzoxazol-7-yl)acetamide (CID 155962162) is 2-(4-aminopyrazol-1-yl)-N-(2-oxo-3H-1,3-benzoxazol-7-yl)acetamide.
What is the SMILES notation for 2-(4-aminopyrazol-1-yl)-N-(2-oxo-3H-1,3-benzoxazol-7-yl)acetamide?
The canonical SMILES for 2-(4-aminopyrazol-1-yl)-N-(2-oxo-3H-1,3-benzoxazol-7-yl)acetamide is Nc1cnn(CC(=O)Nc2cccc3[nH]c(=O)oc23)c1.
What is the InChIKey of 2-(4-aminopyrazol-1-yl)-N-(2-oxo-3H-1,3-benzoxazol-7-yl)acetamide?
The InChIKey is VOZVKOVLZJEDNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N5O3/c13-7-4-14-17(5-7)6-10(18)15-8-2-1-3-9-11(8)20-12(19)16-9/h1-5H,6,13H2,(H,15,18)(H,16,19).
What are the key properties of 2-(4-aminopyrazol-1-yl)-N-(2-oxo-3H-1,3-benzoxazol-7-yl)acetamide?
2-(4-aminopyrazol-1-yl)-N-(2-oxo-3H-1,3-benzoxazol-7-yl)acetamide has a molecular weight of 273.25 g/mol, XLogP of 0.54, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminopyrazol-1-yl)-N-(2-oxo-3H-1,3-benzoxazol-7-yl)acetamide is sourced from PubChem (CID 155962162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).