N-[2-[1-(5-ethyl-4-methyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]pyrazol-3-yl]-2,2-dimethylpropanamide

C20H30N6O2 — CID 42595653

IUPACN-[2-[1-(5-ethyl-4-methyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]pyrazol-3-yl]-2,2-dimethylpropanamide
SMILESCCc1[nH]nc(C(=O)N2CCC(n3nccc3NC(=O)C(C)(C)C)CC2)c1C
InChIInChI=1S/C20H30N6O2/c1-6-15-13(2)17(24-23-15)18(27)25-11-8-14(9-12-25)26-16(7-10-21-26)22-19(28)20(3,4)5/h7,10,14H,6,8-9,11-12H2,1-5H3,(H,22,28)(H,23,24)
InChIKeyMJPNLLUZAYSXCJ-UHFFFAOYSA-N
MW386.50 g/mol
LogP2.94
Rot. Bonds4

About N-[2-[1-(5-ethyl-4-methyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]pyrazol-3-yl]-2,2-dimethylpropanamide

N-[2-[1-(5-ethyl-4-methyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]pyrazol-3-yl]-2,2-dimethylpropanamide (PubChem CID 42595653) has the molecular formula C20H30N6O2 and a molecular weight of 386.50 g/mol. Its IUPAC name is N-[2-[1-(5-ethyl-4-methyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]pyrazol-3-yl]-2,2-dimethylpropanamide.

Molecular Properties

Compound NameN-[2-[1-(5-ethyl-4-methyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]pyrazol-3-yl]-2,2-dimethylpropanamide
PubChem CID42595653
Molecular FormulaC20H30N6O2
Molecular Weight386.50 g/mol
Exact Mass386.24
IUPAC NameN-[2-[1-(5-ethyl-4-methyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]pyrazol-3-yl]-2,2-dimethylpropanamide
SMILESCCc1[nH]nc(C(=O)N2CCC(n3nccc3NC(=O)C(C)(C)C)CC2)c1C
InChIInChI=1S/C20H30N6O2/c1-6-15-13(2)17(24-23-15)18(27)25-11-8-14(9-12-25)26-16(7-10-21-26)22-19(28)20(3,4)5/h7,10,14H,6,8-9,11-12H2,1-5H3,(H,22,28)(H,23,24)
InChIKeyMJPNLLUZAYSXCJ-UHFFFAOYSA-N
XLogP2.94
TPSA95.91 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.50
LogP ≤ 52.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[2-[1-(5-ethyl-4-methyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]pyrazol-3-yl]-2,2-dimethylpropanamide 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-[2-[1-(5-ethyl-4-methyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]pyrazol-3-yl]-2,2-dimethylpropanamide?
The IUPAC name of N-[2-[1-(5-ethyl-4-methyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]pyrazol-3-yl]-2,2-dimethylpropanamide (CID 42595653) is N-[2-[1-(5-ethyl-4-methyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]pyrazol-3-yl]-2,2-dimethylpropanamide.
What is the SMILES notation for N-[2-[1-(5-ethyl-4-methyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]pyrazol-3-yl]-2,2-dimethylpropanamide?
The canonical SMILES for N-[2-[1-(5-ethyl-4-methyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]pyrazol-3-yl]-2,2-dimethylpropanamide is CCc1[nH]nc(C(=O)N2CCC(n3nccc3NC(=O)C(C)(C)C)CC2)c1C.
What is the InChIKey of N-[2-[1-(5-ethyl-4-methyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]pyrazol-3-yl]-2,2-dimethylpropanamide?
The InChIKey is MJPNLLUZAYSXCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H30N6O2/c1-6-15-13(2)17(24-23-15)18(27)25-11-8-14(9-12-25)26-16(7-10-21-26)22-19(28)20(3,4)5/h7,10,14H,6,8-9,11-12H2,1-5H3,(H,22,28)(H,23,24).
What are the key properties of N-[2-[1-(5-ethyl-4-methyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]pyrazol-3-yl]-2,2-dimethylpropanamide?
N-[2-[1-(5-ethyl-4-methyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]pyrazol-3-yl]-2,2-dimethylpropanamide has a molecular weight of 386.50 g/mol, XLogP of 2.94, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[1-(5-ethyl-4-methyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]pyrazol-3-yl]-2,2-dimethylpropanamide is sourced from PubChem (CID 42595653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).