2-[2-hydroxyethyl(methyl)amino]-N-(2-propylpyrazol-3-yl)acetamide

C11H20N4O2 — CID 111123044

IUPAC2-[2-hydroxyethyl(methyl)amino]-N-(2-propylpyrazol-3-yl)acetamide
SMILESCCCn1nccc1NC(=O)CN(C)CCO
InChIInChI=1S/C11H20N4O2/c1-3-6-15-10(4-5-12-15)13-11(17)9-14(2)7-8-16/h4-5,16H,3,6-9H2,1-2H3,(H,13,17)
InChIKeySURMRHWCGQSTEY-UHFFFAOYSA-N
MW240.31 g/mol
LogP0.16
Rot. Bonds7

About 2-[2-hydroxyethyl(methyl)amino]-N-(2-propylpyrazol-3-yl)acetamide

2-[2-hydroxyethyl(methyl)amino]-N-(2-propylpyrazol-3-yl)acetamide (PubChem CID 111123044) has the molecular formula C11H20N4O2 and a molecular weight of 240.31 g/mol. Its IUPAC name is 2-[2-hydroxyethyl(methyl)amino]-N-(2-propylpyrazol-3-yl)acetamide.

Molecular Properties

Compound Name2-[2-hydroxyethyl(methyl)amino]-N-(2-propylpyrazol-3-yl)acetamide
PubChem CID111123044
Molecular FormulaC11H20N4O2
Molecular Weight240.31 g/mol
Exact Mass240.16
IUPAC Name2-[2-hydroxyethyl(methyl)amino]-N-(2-propylpyrazol-3-yl)acetamide
SMILESCCCn1nccc1NC(=O)CN(C)CCO
InChIInChI=1S/C11H20N4O2/c1-3-6-15-10(4-5-12-15)13-11(17)9-14(2)7-8-16/h4-5,16H,3,6-9H2,1-2H3,(H,13,17)
InChIKeySURMRHWCGQSTEY-UHFFFAOYSA-N
XLogP0.16
TPSA70.39 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.31
LogP ≤ 50.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[2-hydroxyethyl(methyl)amino]-N-(2-propylpyrazol-3-yl)acetamide?
The IUPAC name of 2-[2-hydroxyethyl(methyl)amino]-N-(2-propylpyrazol-3-yl)acetamide (CID 111123044) is 2-[2-hydroxyethyl(methyl)amino]-N-(2-propylpyrazol-3-yl)acetamide.
What is the SMILES notation for 2-[2-hydroxyethyl(methyl)amino]-N-(2-propylpyrazol-3-yl)acetamide?
The canonical SMILES for 2-[2-hydroxyethyl(methyl)amino]-N-(2-propylpyrazol-3-yl)acetamide is CCCn1nccc1NC(=O)CN(C)CCO.
What is the InChIKey of 2-[2-hydroxyethyl(methyl)amino]-N-(2-propylpyrazol-3-yl)acetamide?
The InChIKey is SURMRHWCGQSTEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O2/c1-3-6-15-10(4-5-12-15)13-11(17)9-14(2)7-8-16/h4-5,16H,3,6-9H2,1-2H3,(H,13,17).
What are the key properties of 2-[2-hydroxyethyl(methyl)amino]-N-(2-propylpyrazol-3-yl)acetamide?
2-[2-hydroxyethyl(methyl)amino]-N-(2-propylpyrazol-3-yl)acetamide has a molecular weight of 240.31 g/mol, XLogP of 0.16, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-hydroxyethyl(methyl)amino]-N-(2-propylpyrazol-3-yl)acetamide is sourced from PubChem (CID 111123044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).