2-(4-aminopyrazol-1-yl)-N-[(2R)-1-hydroxybutan-2-yl]acetamide

C9H16N4O2 — CID 107211178

IUPAC2-(4-aminopyrazol-1-yl)-N-[(2R)-1-hydroxybutan-2-yl]acetamide
SMILESCC[C@H](CO)NC(=O)Cn1cc(N)cn1
InChIInChI=1S/C9H16N4O2/c1-2-8(6-14)12-9(15)5-13-4-7(10)3-11-13/h3-4,8,14H,2,5-6,10H2,1H3,(H,12,15)/t8-/m1/s1
InChIKeyZDXKDWCORCRNJL-MRVPVSSYSA-N
MW212.25 g/mol
LogP-0.65
Rot. Bonds5

About 2-(4-aminopyrazol-1-yl)-N-[(2R)-1-hydroxybutan-2-yl]acetamide

2-(4-aminopyrazol-1-yl)-N-[(2R)-1-hydroxybutan-2-yl]acetamide (PubChem CID 107211178) has the molecular formula C9H16N4O2 and a molecular weight of 212.25 g/mol. Its IUPAC name is 2-(4-aminopyrazol-1-yl)-N-[(2R)-1-hydroxybutan-2-yl]acetamide.

Molecular Properties

Compound Name2-(4-aminopyrazol-1-yl)-N-[(2R)-1-hydroxybutan-2-yl]acetamide
PubChem CID107211178
Molecular FormulaC9H16N4O2
Molecular Weight212.25 g/mol
Exact Mass212.13
IUPAC Name2-(4-aminopyrazol-1-yl)-N-[(2R)-1-hydroxybutan-2-yl]acetamide
SMILESCC[C@H](CO)NC(=O)Cn1cc(N)cn1
InChIInChI=1S/C9H16N4O2/c1-2-8(6-14)12-9(15)5-13-4-7(10)3-11-13/h3-4,8,14H,2,5-6,10H2,1H3,(H,12,15)/t8-/m1/s1
InChIKeyZDXKDWCORCRNJL-MRVPVSSYSA-N
XLogP-0.65
TPSA93.17 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.25
LogP ≤ 5-0.65
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

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2-(4-aminopyrazol-1-yl)-N-heptan-2-ylacetamide
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N-[(2R)-1-hydroxybutan-2-yl]-2-(triazol-1-yl)acetamide
CID 103920026
N-[(2S)-1-hydroxybutan-2-yl]-2-(triazol-1-yl)acetamide
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2-(4-aminotriazol-1-yl)-N-pentan-3-ylacetamide
CID 165480854
2-(4-aminopyrazol-1-yl)-N-(2,6-diethylphenyl)acetamide
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2-(4-aminopyrazol-1-yl)-N-[1-(oxolan-2-yl)ethyl]acetamide
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Frequently Asked Questions

What is the IUPAC name of 2-(4-aminopyrazol-1-yl)-N-[(2R)-1-hydroxybutan-2-yl]acetamide?
The IUPAC name of 2-(4-aminopyrazol-1-yl)-N-[(2R)-1-hydroxybutan-2-yl]acetamide (CID 107211178) is 2-(4-aminopyrazol-1-yl)-N-[(2R)-1-hydroxybutan-2-yl]acetamide.
What is the SMILES notation for 2-(4-aminopyrazol-1-yl)-N-[(2R)-1-hydroxybutan-2-yl]acetamide?
The canonical SMILES for 2-(4-aminopyrazol-1-yl)-N-[(2R)-1-hydroxybutan-2-yl]acetamide is CC[C@H](CO)NC(=O)Cn1cc(N)cn1.
What is the InChIKey of 2-(4-aminopyrazol-1-yl)-N-[(2R)-1-hydroxybutan-2-yl]acetamide?
The InChIKey is ZDXKDWCORCRNJL-MRVPVSSYSA-N. The full InChI is InChI=1S/C9H16N4O2/c1-2-8(6-14)12-9(15)5-13-4-7(10)3-11-13/h3-4,8,14H,2,5-6,10H2,1H3,(H,12,15)/t8-/m1/s1.
What are the key properties of 2-(4-aminopyrazol-1-yl)-N-[(2R)-1-hydroxybutan-2-yl]acetamide?
2-(4-aminopyrazol-1-yl)-N-[(2R)-1-hydroxybutan-2-yl]acetamide has a molecular weight of 212.25 g/mol, XLogP of -0.65, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminopyrazol-1-yl)-N-[(2R)-1-hydroxybutan-2-yl]acetamide is sourced from PubChem (CID 107211178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).