2-acetamido-N-(1H-pyrazol-5-yl)propanamide

C8H12N4O2 — CID 61393558

IUPAC2-acetamido-N-(1H-pyrazol-5-yl)propanamide
SMILESCC(=O)NC(C)C(=O)Nc1ccn[nH]1
InChIInChI=1S/C8H12N4O2/c1-5(10-6(2)13)8(14)11-7-3-4-9-12-7/h3-5H,1-2H3,(H,10,13)(H2,9,11,12,14)
InChIKeyRQZLQXYREOSQDO-UHFFFAOYSA-N
MW196.21 g/mol
LogP-0.13
Rot. Bonds3

About 2-acetamido-N-(1H-pyrazol-5-yl)propanamide

2-acetamido-N-(1H-pyrazol-5-yl)propanamide (PubChem CID 61393558) has the molecular formula C8H12N4O2 and a molecular weight of 196.21 g/mol. Its IUPAC name is 2-acetamido-N-(1H-pyrazol-5-yl)propanamide.

Molecular Properties

Compound Name2-acetamido-N-(1H-pyrazol-5-yl)propanamide
PubChem CID61393558
Molecular FormulaC8H12N4O2
Molecular Weight196.21 g/mol
Exact Mass196.10
IUPAC Name2-acetamido-N-(1H-pyrazol-5-yl)propanamide
SMILESCC(=O)NC(C)C(=O)Nc1ccn[nH]1
InChIInChI=1S/C8H12N4O2/c1-5(10-6(2)13)8(14)11-7-3-4-9-12-7/h3-5H,1-2H3,(H,10,13)(H2,9,11,12,14)
InChIKeyRQZLQXYREOSQDO-UHFFFAOYSA-N
XLogP-0.13
TPSA86.88 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.21
LogP ≤ 5-0.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-methoxy-N-(1H-pyrazol-5-yl)propanamide
CID 115596669
2-acetamido-N-(1H-pyrazol-5-ylmethyl)propanamide
CID 60975273
2-propyl-N-(1H-pyrazol-5-yl)pentanamide
CID 115532341
2-azido-N-(1H-pyrazol-5-yl)propanamide
CID 57031740
2-(carbamoylamino)-3-methyl-N-(1H-pyrazol-5-yl)pentanamide
CID 61393913
(2S)-2-(4-chlorophenyl)-3-methyl-N-(1H-pyrazol-5-yl)butanamide
CID 46226178
(2R)-N-(1H-pyrazol-5-yl)-2-(thiophen-2-ylsulfonylamino)propanamide
CID 95280952
2-ethyl-N-(1H-pyrazol-5-yl)hexanamide
CID 61393178
2-acetamido-N-(1H-pyrazol-5-yl)-1,3-thiazole-4-carboxamide
CID 47388391
2-propan-2-yloxy-N-(1H-pyrazol-5-yl)acetamide
CID 112687554
2-acetamido-N-(5-methyl-1H-pyrazol-3-yl)propanamide
CID 63819909
3-acetamido-N-(1H-pyrazol-5-yl)propanamide
CID 61393399

Frequently Asked Questions

What is the IUPAC name of 2-acetamido-N-(1H-pyrazol-5-yl)propanamide?
The IUPAC name of 2-acetamido-N-(1H-pyrazol-5-yl)propanamide (CID 61393558) is 2-acetamido-N-(1H-pyrazol-5-yl)propanamide.
What is the SMILES notation for 2-acetamido-N-(1H-pyrazol-5-yl)propanamide?
The canonical SMILES for 2-acetamido-N-(1H-pyrazol-5-yl)propanamide is CC(=O)NC(C)C(=O)Nc1ccn[nH]1.
What is the InChIKey of 2-acetamido-N-(1H-pyrazol-5-yl)propanamide?
The InChIKey is RQZLQXYREOSQDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N4O2/c1-5(10-6(2)13)8(14)11-7-3-4-9-12-7/h3-5H,1-2H3,(H,10,13)(H2,9,11,12,14).
What are the key properties of 2-acetamido-N-(1H-pyrazol-5-yl)propanamide?
2-acetamido-N-(1H-pyrazol-5-yl)propanamide has a molecular weight of 196.21 g/mol, XLogP of -0.13, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-acetamido-N-(1H-pyrazol-5-yl)propanamide is sourced from PubChem (CID 61393558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).