2-(3-aminopyrazol-1-yl)-N-ethyl-N-(2-hydroxyethyl)acetamide

C9H16N4O2 — CID 62102871

IUPAC2-(3-aminopyrazol-1-yl)-N-ethyl-N-(2-hydroxyethyl)acetamide
SMILESCCN(CCO)C(=O)Cn1ccc(N)n1
InChIInChI=1S/C9H16N4O2/c1-2-12(5-6-14)9(15)7-13-4-3-8(10)11-13/h3-4,14H,2,5-7H2,1H3,(H2,10,11)
InChIKeyGJTGRVVSMXANOC-UHFFFAOYSA-N
MW212.25 g/mol
LogP-0.69
Rot. Bonds5

About 2-(3-aminopyrazol-1-yl)-N-ethyl-N-(2-hydroxyethyl)acetamide

2-(3-aminopyrazol-1-yl)-N-ethyl-N-(2-hydroxyethyl)acetamide (PubChem CID 62102871) has the molecular formula C9H16N4O2 and a molecular weight of 212.25 g/mol. Its IUPAC name is 2-(3-aminopyrazol-1-yl)-N-ethyl-N-(2-hydroxyethyl)acetamide.

Molecular Properties

Compound Name2-(3-aminopyrazol-1-yl)-N-ethyl-N-(2-hydroxyethyl)acetamide
PubChem CID62102871
Molecular FormulaC9H16N4O2
Molecular Weight212.25 g/mol
Exact Mass212.13
IUPAC Name2-(3-aminopyrazol-1-yl)-N-ethyl-N-(2-hydroxyethyl)acetamide
SMILESCCN(CCO)C(=O)Cn1ccc(N)n1
InChIInChI=1S/C9H16N4O2/c1-2-12(5-6-14)9(15)7-13-4-3-8(10)11-13/h3-4,14H,2,5-7H2,1H3,(H2,10,11)
InChIKeyGJTGRVVSMXANOC-UHFFFAOYSA-N
XLogP-0.69
TPSA84.38 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.25
LogP ≤ 5-0.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(3-aminopyrazol-1-yl)-N,N-dipentylacetamide
CID 62113064
2-(3-aminopyrazol-1-yl)-N-[2-(dimethylamino)ethyl]-N-methylacetamide
CID 63693887
2-(3-aminopyrazol-1-yl)-N-benzyl-N-propylacetamide
CID 62102852
2-(3-aminopyrazol-1-yl)-N-(cyclopropylmethyl)-N-propylacetamide
CID 55035543
N-(2-amino-2-oxoethyl)-2-(3-aminopyrazol-1-yl)-N-methylacetamide
CID 62101394
2-(3-aminopyrazol-1-yl)-N-(2-methoxyethyl)-N-methylacetamide
CID 62113912
N-ethyl-N-(3-hydroxypropyl)-2-(3-nitropyrazol-1-yl)acetamide
CID 115771713
2-(3-aminopyrazol-1-yl)-N-(cyclopentylmethyl)-N-methylacetamide
CID 63630834
2-(3-aminopyrazol-1-yl)acetic acid;hydrochloride
CID 68584294
2-(3-aminopyrazol-1-yl)-N-(2-methoxyethyl)-N-propan-2-ylacetamide
CID 82947950
2-(3-aminopyrazol-1-yl)-N-methyl-N-[2-(methylamino)-2-oxoethyl]acetamide
CID 62101395
2-(3-aminopyrazol-1-yl)-N-methylacetamide
CID 60783095

Frequently Asked Questions

What is the IUPAC name of 2-(3-aminopyrazol-1-yl)-N-ethyl-N-(2-hydroxyethyl)acetamide?
The IUPAC name of 2-(3-aminopyrazol-1-yl)-N-ethyl-N-(2-hydroxyethyl)acetamide (CID 62102871) is 2-(3-aminopyrazol-1-yl)-N-ethyl-N-(2-hydroxyethyl)acetamide.
What is the SMILES notation for 2-(3-aminopyrazol-1-yl)-N-ethyl-N-(2-hydroxyethyl)acetamide?
The canonical SMILES for 2-(3-aminopyrazol-1-yl)-N-ethyl-N-(2-hydroxyethyl)acetamide is CCN(CCO)C(=O)Cn1ccc(N)n1.
What is the InChIKey of 2-(3-aminopyrazol-1-yl)-N-ethyl-N-(2-hydroxyethyl)acetamide?
The InChIKey is GJTGRVVSMXANOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N4O2/c1-2-12(5-6-14)9(15)7-13-4-3-8(10)11-13/h3-4,14H,2,5-7H2,1H3,(H2,10,11).
What are the key properties of 2-(3-aminopyrazol-1-yl)-N-ethyl-N-(2-hydroxyethyl)acetamide?
2-(3-aminopyrazol-1-yl)-N-ethyl-N-(2-hydroxyethyl)acetamide has a molecular weight of 212.25 g/mol, XLogP of -0.69, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-aminopyrazol-1-yl)-N-ethyl-N-(2-hydroxyethyl)acetamide is sourced from PubChem (CID 62102871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).