4-amino-5-ethyl-N-(3,3,5,5-tetramethylcyclohexyl)-1H-pyrazole-3-carboxamide

C16H28N4O — CID 103965110

IUPAC4-amino-5-ethyl-N-(3,3,5,5-tetramethylcyclohexyl)-1H-pyrazole-3-carboxamide
SMILESCCc1[nH]nc(C(=O)NC2CC(C)(C)CC(C)(C)C2)c1N
InChIInChI=1S/C16H28N4O/c1-6-11-12(17)13(20-19-11)14(21)18-10-7-15(2,3)9-16(4,5)8-10/h10H,6-9,17H2,1-5H3,(H,18,21)(H,19,20)
InChIKeyXLPUSMKREXCFRS-UHFFFAOYSA-N
MW292.43 g/mol
LogP2.89
Rot. Bonds3

About 4-amino-5-ethyl-N-(3,3,5,5-tetramethylcyclohexyl)-1H-pyrazole-3-carboxamide

4-amino-5-ethyl-N-(3,3,5,5-tetramethylcyclohexyl)-1H-pyrazole-3-carboxamide (PubChem CID 103965110) has the molecular formula C16H28N4O and a molecular weight of 292.43 g/mol. Its IUPAC name is 4-amino-5-ethyl-N-(3,3,5,5-tetramethylcyclohexyl)-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound Name4-amino-5-ethyl-N-(3,3,5,5-tetramethylcyclohexyl)-1H-pyrazole-3-carboxamide
PubChem CID103965110
Molecular FormulaC16H28N4O
Molecular Weight292.43 g/mol
Exact Mass292.23
IUPAC Name4-amino-5-ethyl-N-(3,3,5,5-tetramethylcyclohexyl)-1H-pyrazole-3-carboxamide
SMILESCCc1[nH]nc(C(=O)NC2CC(C)(C)CC(C)(C)C2)c1N
InChIInChI=1S/C16H28N4O/c1-6-11-12(17)13(20-19-11)14(21)18-10-7-15(2,3)9-16(4,5)8-10/h10H,6-9,17H2,1-5H3,(H,18,21)(H,19,20)
InChIKeyXLPUSMKREXCFRS-UHFFFAOYSA-N
XLogP2.89
TPSA83.80 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.43
LogP ≤ 52.89
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 4-amino-5-ethyl-N-(3,3,5,5-tetramethylcyclohexyl)-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

Frequently Asked Questions

What is the IUPAC name of 4-amino-5-ethyl-N-(3,3,5,5-tetramethylcyclohexyl)-1H-pyrazole-3-carboxamide?
The IUPAC name of 4-amino-5-ethyl-N-(3,3,5,5-tetramethylcyclohexyl)-1H-pyrazole-3-carboxamide (CID 103965110) is 4-amino-5-ethyl-N-(3,3,5,5-tetramethylcyclohexyl)-1H-pyrazole-3-carboxamide.
What is the SMILES notation for 4-amino-5-ethyl-N-(3,3,5,5-tetramethylcyclohexyl)-1H-pyrazole-3-carboxamide?
The canonical SMILES for 4-amino-5-ethyl-N-(3,3,5,5-tetramethylcyclohexyl)-1H-pyrazole-3-carboxamide is CCc1[nH]nc(C(=O)NC2CC(C)(C)CC(C)(C)C2)c1N.
What is the InChIKey of 4-amino-5-ethyl-N-(3,3,5,5-tetramethylcyclohexyl)-1H-pyrazole-3-carboxamide?
The InChIKey is XLPUSMKREXCFRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N4O/c1-6-11-12(17)13(20-19-11)14(21)18-10-7-15(2,3)9-16(4,5)8-10/h10H,6-9,17H2,1-5H3,(H,18,21)(H,19,20).
What are the key properties of 4-amino-5-ethyl-N-(3,3,5,5-tetramethylcyclohexyl)-1H-pyrazole-3-carboxamide?
4-amino-5-ethyl-N-(3,3,5,5-tetramethylcyclohexyl)-1H-pyrazole-3-carboxamide has a molecular weight of 292.43 g/mol, XLogP of 2.89, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-5-ethyl-N-(3,3,5,5-tetramethylcyclohexyl)-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 103965110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).