4-amino-N-(2-methoxyethyl)-5-methyl-N-propan-2-yl-1H-pyrazole-3-carboxamide

C11H20N4O2 — CID 82949294

IUPAC4-amino-N-(2-methoxyethyl)-5-methyl-N-propan-2-yl-1H-pyrazole-3-carboxamide
SMILESCOCCN(C(=O)c1n[nH]c(C)c1N)C(C)C
InChIInChI=1S/C11H20N4O2/c1-7(2)15(5-6-17-4)11(16)10-9(12)8(3)13-14-10/h7H,5-6,12H2,1-4H3,(H,13,14)
InChIKeyCABKAVKWTOPUDD-UHFFFAOYSA-N
MW240.31 g/mol
LogP0.80
Rot. Bonds5

About 4-amino-N-(2-methoxyethyl)-5-methyl-N-propan-2-yl-1H-pyrazole-3-carboxamide

4-amino-N-(2-methoxyethyl)-5-methyl-N-propan-2-yl-1H-pyrazole-3-carboxamide (PubChem CID 82949294) has the molecular formula C11H20N4O2 and a molecular weight of 240.31 g/mol. Its IUPAC name is 4-amino-N-(2-methoxyethyl)-5-methyl-N-propan-2-yl-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-(2-methoxyethyl)-5-methyl-N-propan-2-yl-1H-pyrazole-3-carboxamide
PubChem CID82949294
Molecular FormulaC11H20N4O2
Molecular Weight240.31 g/mol
Exact Mass240.16
IUPAC Name4-amino-N-(2-methoxyethyl)-5-methyl-N-propan-2-yl-1H-pyrazole-3-carboxamide
SMILESCOCCN(C(=O)c1n[nH]c(C)c1N)C(C)C
InChIInChI=1S/C11H20N4O2/c1-7(2)15(5-6-17-4)11(16)10-9(12)8(3)13-14-10/h7H,5-6,12H2,1-4H3,(H,13,14)
InChIKeyCABKAVKWTOPUDD-UHFFFAOYSA-N
XLogP0.80
TPSA84.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.31
LogP ≤ 50.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-amino-N-(2-methoxyethyl)-5-methyl-N-propan-2-yl-1H-pyrazole-3-carboxamide 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

4-amino-N-[2-(2-methoxyethoxy)ethyl]-5-methyl-1H-pyrazole-3-carboxamide
CID 55034477
4-amino-N,5-dimethyl-N-(2-propan-2-yloxyethyl)-1H-pyrazole-3-carboxamide
CID 81053725
4-amino-5-ethyl-N-(2-methoxyethyl)-N-pentan-3-yl-1H-pyrazole-3-carboxamide
CID 62081656
4-amino-N-pentyl-N,5-di(propan-2-yl)-1H-pyrazole-3-carboxamide
CID 62076734
4-amino-N-(2,3-dimethylbutyl)-5-methyl-1H-pyrazole-3-carboxamide
CID 64570786
4-amino-N-(2-hydroxypropyl)-N,5-dimethyl-1H-pyrazole-3-carboxamide
CID 62333257
2-[(4-amino-5-methyl-1H-pyrazole-3-carbonyl)amino]ethyl carbamate
CID 83202712
4-amino-N-[(2S)-1-hydroxypropan-2-yl]-5-methyl-1H-pyrazole-3-carboxamide
CID 94344980
4-amino-5-methyl-N-(4-methylpentyl)-1H-pyrazole-3-carboxamide
CID 62083375
4-amino-N-(2-hydroxyethyl)-5-methyl-1H-pyrazole-3-carboxamide
CID 62082092
4-amino-5-methyl-N-(2-methylsulfonylethyl)-1H-pyrazole-3-carboxamide
CID 62082279
4-amino-N-(2,2-dimethylpropyl)-5-methyl-1H-pyrazole-3-carboxamide
CID 62080909

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(2-methoxyethyl)-5-methyl-N-propan-2-yl-1H-pyrazole-3-carboxamide?
The IUPAC name of 4-amino-N-(2-methoxyethyl)-5-methyl-N-propan-2-yl-1H-pyrazole-3-carboxamide (CID 82949294) is 4-amino-N-(2-methoxyethyl)-5-methyl-N-propan-2-yl-1H-pyrazole-3-carboxamide.
What is the SMILES notation for 4-amino-N-(2-methoxyethyl)-5-methyl-N-propan-2-yl-1H-pyrazole-3-carboxamide?
The canonical SMILES for 4-amino-N-(2-methoxyethyl)-5-methyl-N-propan-2-yl-1H-pyrazole-3-carboxamide is COCCN(C(=O)c1n[nH]c(C)c1N)C(C)C.
What is the InChIKey of 4-amino-N-(2-methoxyethyl)-5-methyl-N-propan-2-yl-1H-pyrazole-3-carboxamide?
The InChIKey is CABKAVKWTOPUDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O2/c1-7(2)15(5-6-17-4)11(16)10-9(12)8(3)13-14-10/h7H,5-6,12H2,1-4H3,(H,13,14).
What are the key properties of 4-amino-N-(2-methoxyethyl)-5-methyl-N-propan-2-yl-1H-pyrazole-3-carboxamide?
4-amino-N-(2-methoxyethyl)-5-methyl-N-propan-2-yl-1H-pyrazole-3-carboxamide has a molecular weight of 240.31 g/mol, XLogP of 0.80, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(2-methoxyethyl)-5-methyl-N-propan-2-yl-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 82949294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).