2-acetamido-N-(4,5-dimethyl-1H-pyrazol-3-yl)propanamide

C10H16N4O2 — CID 115624602

IUPAC2-acetamido-N-(4,5-dimethyl-1H-pyrazol-3-yl)propanamide
SMILESCC(=O)NC(C)C(=O)Nc1n[nH]c(C)c1C
InChIInChI=1S/C10H16N4O2/c1-5-6(2)13-14-9(5)12-10(16)7(3)11-8(4)15/h7H,1-4H3,(H,11,15)(H2,12,13,14,16)
InChIKeyZBLDAYLOTXSOEV-UHFFFAOYSA-N
MW224.26 g/mol
LogP0.49
Rot. Bonds3

About 2-acetamido-N-(4,5-dimethyl-1H-pyrazol-3-yl)propanamide

2-acetamido-N-(4,5-dimethyl-1H-pyrazol-3-yl)propanamide (PubChem CID 115624602) has the molecular formula C10H16N4O2 and a molecular weight of 224.26 g/mol. Its IUPAC name is 2-acetamido-N-(4,5-dimethyl-1H-pyrazol-3-yl)propanamide.

Molecular Properties

Compound Name2-acetamido-N-(4,5-dimethyl-1H-pyrazol-3-yl)propanamide
PubChem CID115624602
Molecular FormulaC10H16N4O2
Molecular Weight224.26 g/mol
Exact Mass224.13
IUPAC Name2-acetamido-N-(4,5-dimethyl-1H-pyrazol-3-yl)propanamide
SMILESCC(=O)NC(C)C(=O)Nc1n[nH]c(C)c1C
InChIInChI=1S/C10H16N4O2/c1-5-6(2)13-14-9(5)12-10(16)7(3)11-8(4)15/h7H,1-4H3,(H,11,15)(H2,12,13,14,16)
InChIKeyZBLDAYLOTXSOEV-UHFFFAOYSA-N
XLogP0.49
TPSA86.88 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 50.49
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-acetamido-N-(5-methyl-1H-pyrazol-3-yl)propanamide
CID 63819909
2-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)butanamide
CID 104618696
2-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-methoxypropanamide
CID 104618673
3-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)-2-methoxypropanamide
CID 106113701
(2S)-2-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)hexanamide
CID 107146509
2-chloro-N-(4,5-dimethyl-1H-pyrazol-3-yl)acetamide
CID 104617747
2-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)acetamide
CID 104618733
2-(carbamoylamino)-N-(4,5-dimethyl-1H-pyrazol-3-yl)-4-methylsulfanylbutanamide
CID 112689375
2-acetamido-N-(1H-pyrazol-5-yl)propanamide
CID 61393558
2-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)-5-methoxypentanamide
CID 104618869
(2R)-2-acetamido-N-(5-tert-butyl-1H-pyrazol-3-yl)propanamide
CID 95294416
5-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)hexanamide
CID 104618844

Frequently Asked Questions

What is the IUPAC name of 2-acetamido-N-(4,5-dimethyl-1H-pyrazol-3-yl)propanamide?
The IUPAC name of 2-acetamido-N-(4,5-dimethyl-1H-pyrazol-3-yl)propanamide (CID 115624602) is 2-acetamido-N-(4,5-dimethyl-1H-pyrazol-3-yl)propanamide.
What is the SMILES notation for 2-acetamido-N-(4,5-dimethyl-1H-pyrazol-3-yl)propanamide?
The canonical SMILES for 2-acetamido-N-(4,5-dimethyl-1H-pyrazol-3-yl)propanamide is CC(=O)NC(C)C(=O)Nc1n[nH]c(C)c1C.
What is the InChIKey of 2-acetamido-N-(4,5-dimethyl-1H-pyrazol-3-yl)propanamide?
The InChIKey is ZBLDAYLOTXSOEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O2/c1-5-6(2)13-14-9(5)12-10(16)7(3)11-8(4)15/h7H,1-4H3,(H,11,15)(H2,12,13,14,16).
What are the key properties of 2-acetamido-N-(4,5-dimethyl-1H-pyrazol-3-yl)propanamide?
2-acetamido-N-(4,5-dimethyl-1H-pyrazol-3-yl)propanamide has a molecular weight of 224.26 g/mol, XLogP of 0.49, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-acetamido-N-(4,5-dimethyl-1H-pyrazol-3-yl)propanamide is sourced from PubChem (CID 115624602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).