2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-N-(2-propan-2-ylpyrazol-3-yl)acetamide

C14H26N4O2 — CID 78964876

IUPAC2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-N-(2-propan-2-ylpyrazol-3-yl)acetamide
SMILESCCN(CC(=O)Nc1ccnn1C(C)C)CC(C)(C)O
InChIInChI=1S/C14H26N4O2/c1-6-17(10-14(4,5)20)9-13(19)16-12-7-8-15-18(12)11(2)3/h7-8,11,20H,6,9-10H2,1-5H3,(H,16,19)
InChIKeySWOBLGDRHYWVAG-UHFFFAOYSA-N
MW282.39 g/mol
LogP1.50
Rot. Bonds7

About 2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-N-(2-propan-2-ylpyrazol-3-yl)acetamide

2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-N-(2-propan-2-ylpyrazol-3-yl)acetamide (PubChem CID 78964876) has the molecular formula C14H26N4O2 and a molecular weight of 282.39 g/mol. Its IUPAC name is 2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-N-(2-propan-2-ylpyrazol-3-yl)acetamide.

Molecular Properties

Compound Name2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-N-(2-propan-2-ylpyrazol-3-yl)acetamide
PubChem CID78964876
Molecular FormulaC14H26N4O2
Molecular Weight282.39 g/mol
Exact Mass282.21
IUPAC Name2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-N-(2-propan-2-ylpyrazol-3-yl)acetamide
SMILESCCN(CC(=O)Nc1ccnn1C(C)C)CC(C)(C)O
InChIInChI=1S/C14H26N4O2/c1-6-17(10-14(4,5)20)9-13(19)16-12-7-8-15-18(12)11(2)3/h7-8,11,20H,6,9-10H2,1-5H3,(H,16,19)
InChIKeySWOBLGDRHYWVAG-UHFFFAOYSA-N
XLogP1.50
TPSA70.39 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 51.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-N-(2-propan-2-ylpyrazol-3-yl)acetamide?
The IUPAC name of 2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-N-(2-propan-2-ylpyrazol-3-yl)acetamide (CID 78964876) is 2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-N-(2-propan-2-ylpyrazol-3-yl)acetamide.
What is the SMILES notation for 2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-N-(2-propan-2-ylpyrazol-3-yl)acetamide?
The canonical SMILES for 2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-N-(2-propan-2-ylpyrazol-3-yl)acetamide is CCN(CC(=O)Nc1ccnn1C(C)C)CC(C)(C)O.
What is the InChIKey of 2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-N-(2-propan-2-ylpyrazol-3-yl)acetamide?
The InChIKey is SWOBLGDRHYWVAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4O2/c1-6-17(10-14(4,5)20)9-13(19)16-12-7-8-15-18(12)11(2)3/h7-8,11,20H,6,9-10H2,1-5H3,(H,16,19).
What are the key properties of 2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-N-(2-propan-2-ylpyrazol-3-yl)acetamide?
2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-N-(2-propan-2-ylpyrazol-3-yl)acetamide has a molecular weight of 282.39 g/mol, XLogP of 1.50, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-N-(2-propan-2-ylpyrazol-3-yl)acetamide is sourced from PubChem (CID 78964876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).