2-(3-aminopyrazol-1-yl)-N-[(1R)-1-phenylethyl]acetamide

C13H16N4O — CID 107863852

IUPAC2-(3-aminopyrazol-1-yl)-N-[(1R)-1-phenylethyl]acetamide
SMILESC[C@@H](NC(=O)Cn1ccc(N)n1)c1ccccc1
InChIInChI=1S/C13H16N4O/c1-10(11-5-3-2-4-6-11)15-13(18)9-17-8-7-12(14)16-17/h2-8,10H,9H2,1H3,(H2,14,16)(H,15,18)/t10-/m1/s1
InChIKeyLXVOIKLOFYNVBV-SNVBAGLBSA-N
MW244.30 g/mol
LogP1.34
Rot. Bonds4

About 2-(3-aminopyrazol-1-yl)-N-[(1R)-1-phenylethyl]acetamide

2-(3-aminopyrazol-1-yl)-N-[(1R)-1-phenylethyl]acetamide (PubChem CID 107863852) has the molecular formula C13H16N4O and a molecular weight of 244.30 g/mol. Its IUPAC name is 2-(3-aminopyrazol-1-yl)-N-[(1R)-1-phenylethyl]acetamide.

Molecular Properties

Compound Name2-(3-aminopyrazol-1-yl)-N-[(1R)-1-phenylethyl]acetamide
PubChem CID107863852
Molecular FormulaC13H16N4O
Molecular Weight244.30 g/mol
Exact Mass244.13
IUPAC Name2-(3-aminopyrazol-1-yl)-N-[(1R)-1-phenylethyl]acetamide
SMILESC[C@@H](NC(=O)Cn1ccc(N)n1)c1ccccc1
InChIInChI=1S/C13H16N4O/c1-10(11-5-3-2-4-6-11)15-13(18)9-17-8-7-12(14)16-17/h2-8,10H,9H2,1H3,(H2,14,16)(H,15,18)/t10-/m1/s1
InChIKeyLXVOIKLOFYNVBV-SNVBAGLBSA-N
XLogP1.34
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.30
LogP ≤ 51.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3-aminopyrazol-1-yl)-N-(1-pyridin-2-ylethyl)acetamide
CID 62101552
2-(3-aminopyrazol-1-yl)-N-(1-thiophen-2-ylethyl)acetamide
CID 62102541
2-(3-aminopyrazol-1-yl)-N-(3-phenylbutyl)acetamide
CID 62986610
2-(3-aminopyrazol-1-yl)-N-butan-2-ylacetamide
CID 60783220
2-[[2-(3-aminopyrazol-1-yl)acetyl]amino]propanamide
CID 62101706
2-(3-aminopyrazol-1-yl)-N-(4-hydroxybutan-2-yl)acetamide
CID 83176621
2-(3-aminopyrazol-1-yl)-N-hexan-2-ylacetamide
CID 62197855
N-(1-phenylethyl)-2-pyrrol-1-ylacetamide
CID 20880526
2-(3-aminopyrazol-1-yl)-N-methylacetamide
CID 60783095
2-[4-(aminomethyl)triazol-1-yl]-N-[(1R)-1-phenylethyl]acetamide
CID 115459911
2-(4-bromo-3-methylpyrazol-1-yl)-N-(1-phenylethyl)acetamide
CID 19517136
N-(1-phenylethyl)-2-[3-(3-pyrimidin-5-ylphenyl)pyrazol-1-yl]acetamide
CID 45177485

Frequently Asked Questions

What is the IUPAC name of 2-(3-aminopyrazol-1-yl)-N-[(1R)-1-phenylethyl]acetamide?
The IUPAC name of 2-(3-aminopyrazol-1-yl)-N-[(1R)-1-phenylethyl]acetamide (CID 107863852) is 2-(3-aminopyrazol-1-yl)-N-[(1R)-1-phenylethyl]acetamide.
What is the SMILES notation for 2-(3-aminopyrazol-1-yl)-N-[(1R)-1-phenylethyl]acetamide?
The canonical SMILES for 2-(3-aminopyrazol-1-yl)-N-[(1R)-1-phenylethyl]acetamide is C[C@@H](NC(=O)Cn1ccc(N)n1)c1ccccc1.
What is the InChIKey of 2-(3-aminopyrazol-1-yl)-N-[(1R)-1-phenylethyl]acetamide?
The InChIKey is LXVOIKLOFYNVBV-SNVBAGLBSA-N. The full InChI is InChI=1S/C13H16N4O/c1-10(11-5-3-2-4-6-11)15-13(18)9-17-8-7-12(14)16-17/h2-8,10H,9H2,1H3,(H2,14,16)(H,15,18)/t10-/m1/s1.
What are the key properties of 2-(3-aminopyrazol-1-yl)-N-[(1R)-1-phenylethyl]acetamide?
2-(3-aminopyrazol-1-yl)-N-[(1R)-1-phenylethyl]acetamide has a molecular weight of 244.30 g/mol, XLogP of 1.34, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-aminopyrazol-1-yl)-N-[(1R)-1-phenylethyl]acetamide is sourced from PubChem (CID 107863852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).