2-amino-N-(2,2-diethyloxan-4-yl)-2-(1-methylpyrazol-4-yl)acetamide

C15H26N4O2 — CID 83036652

IUPAC2-amino-N-(2,2-diethyloxan-4-yl)-2-(1-methylpyrazol-4-yl)acetamide
SMILESCCC1(CC)CC(NC(=O)C(N)c2cnn(C)c2)CCO1
InChIInChI=1S/C15H26N4O2/c1-4-15(5-2)8-12(6-7-21-15)18-14(20)13(16)11-9-17-19(3)10-11/h9-10,12-13H,4-8,16H2,1-3H3,(H,18,20)
InChIKeyJRAIOJHRECOHLN-UHFFFAOYSA-N
MW294.40 g/mol
LogP1.27
Rot. Bonds5

About 2-amino-N-(2,2-diethyloxan-4-yl)-2-(1-methylpyrazol-4-yl)acetamide

2-amino-N-(2,2-diethyloxan-4-yl)-2-(1-methylpyrazol-4-yl)acetamide (PubChem CID 83036652) has the molecular formula C15H26N4O2 and a molecular weight of 294.40 g/mol. Its IUPAC name is 2-amino-N-(2,2-diethyloxan-4-yl)-2-(1-methylpyrazol-4-yl)acetamide.

Molecular Properties

Compound Name2-amino-N-(2,2-diethyloxan-4-yl)-2-(1-methylpyrazol-4-yl)acetamide
PubChem CID83036652
Molecular FormulaC15H26N4O2
Molecular Weight294.40 g/mol
Exact Mass294.21
IUPAC Name2-amino-N-(2,2-diethyloxan-4-yl)-2-(1-methylpyrazol-4-yl)acetamide
SMILESCCC1(CC)CC(NC(=O)C(N)c2cnn(C)c2)CCO1
InChIInChI=1S/C15H26N4O2/c1-4-15(5-2)8-12(6-7-21-15)18-14(20)13(16)11-9-17-19(3)10-11/h9-10,12-13H,4-8,16H2,1-3H3,(H,18,20)
InChIKeyJRAIOJHRECOHLN-UHFFFAOYSA-N
XLogP1.27
TPSA82.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.40
LogP ≤ 51.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2,2-diethyloxan-4-yl)-2-(1-methylpyrazol-4-yl)acetamide?
The IUPAC name of 2-amino-N-(2,2-diethyloxan-4-yl)-2-(1-methylpyrazol-4-yl)acetamide (CID 83036652) is 2-amino-N-(2,2-diethyloxan-4-yl)-2-(1-methylpyrazol-4-yl)acetamide.
What is the SMILES notation for 2-amino-N-(2,2-diethyloxan-4-yl)-2-(1-methylpyrazol-4-yl)acetamide?
The canonical SMILES for 2-amino-N-(2,2-diethyloxan-4-yl)-2-(1-methylpyrazol-4-yl)acetamide is CCC1(CC)CC(NC(=O)C(N)c2cnn(C)c2)CCO1.
What is the InChIKey of 2-amino-N-(2,2-diethyloxan-4-yl)-2-(1-methylpyrazol-4-yl)acetamide?
The InChIKey is JRAIOJHRECOHLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O2/c1-4-15(5-2)8-12(6-7-21-15)18-14(20)13(16)11-9-17-19(3)10-11/h9-10,12-13H,4-8,16H2,1-3H3,(H,18,20).
What are the key properties of 2-amino-N-(2,2-diethyloxan-4-yl)-2-(1-methylpyrazol-4-yl)acetamide?
2-amino-N-(2,2-diethyloxan-4-yl)-2-(1-methylpyrazol-4-yl)acetamide has a molecular weight of 294.40 g/mol, XLogP of 1.27, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2,2-diethyloxan-4-yl)-2-(1-methylpyrazol-4-yl)acetamide is sourced from PubChem (CID 83036652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).