2-acetamido-N-(5-methyl-1H-pyrazol-3-yl)propanamide

C9H14N4O2 — CID 63819909

IUPAC2-acetamido-N-(5-methyl-1H-pyrazol-3-yl)propanamide
SMILESCC(=O)NC(C)C(=O)Nc1cc(C)[nH]n1
InChIInChI=1S/C9H14N4O2/c1-5-4-8(13-12-5)11-9(15)6(2)10-7(3)14/h4,6H,1-3H3,(H,10,14)(H2,11,12,13,15)
InChIKeyQCSJVXPSONMQLJ-UHFFFAOYSA-N
MW210.24 g/mol
LogP0.18
Rot. Bonds3

About 2-acetamido-N-(5-methyl-1H-pyrazol-3-yl)propanamide

2-acetamido-N-(5-methyl-1H-pyrazol-3-yl)propanamide (PubChem CID 63819909) has the molecular formula C9H14N4O2 and a molecular weight of 210.24 g/mol. Its IUPAC name is 2-acetamido-N-(5-methyl-1H-pyrazol-3-yl)propanamide.

Molecular Properties

Compound Name2-acetamido-N-(5-methyl-1H-pyrazol-3-yl)propanamide
PubChem CID63819909
Molecular FormulaC9H14N4O2
Molecular Weight210.24 g/mol
Exact Mass210.11
IUPAC Name2-acetamido-N-(5-methyl-1H-pyrazol-3-yl)propanamide
SMILESCC(=O)NC(C)C(=O)Nc1cc(C)[nH]n1
InChIInChI=1S/C9H14N4O2/c1-5-4-8(13-12-5)11-9(15)6(2)10-7(3)14/h4,6H,1-3H3,(H,10,14)(H2,11,12,13,15)
InChIKeyQCSJVXPSONMQLJ-UHFFFAOYSA-N
XLogP0.18
TPSA86.88 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.24
LogP ≤ 50.18
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-acetamido-N-(5-tert-butyl-1H-pyrazol-3-yl)propanamide
CID 95294416
2-hydroxy-N-(5-methyl-1H-pyrazol-3-yl)propanamide
CID 117099978
N-[1-[(5-methyl-1H-pyrazol-3-yl)amino]-1-oxopropan-2-yl]furan-2-carboxamide
CID 47289682
2-ethyl-N-(5-methyl-1H-pyrazol-3-yl)butanamide
CID 63820066
(2R)-2-methyl-N-(5-methyl-1H-pyrazol-3-yl)-3-methylsulfanylpropanamide
CID 95626076
(5-methyl-1H-pyrazol-3-yl)carbamic acid
CID 23091960
2-acetamido-N-(4,5-dimethyl-1H-pyrazol-3-yl)propanamide
CID 115624602
(2S)-2-amino-3-methyl-N-(5-methyl-1H-pyrazol-3-yl)pentanamide
CID 63823173
N-(5-tert-butyl-1H-pyrazol-3-yl)-2-(carbamoylamino)propanamide
CID 112686898
6-amino-2-methyl-N-(5-methyl-1H-pyrazol-3-yl)heptanamide
CID 65291097
2-acetamido-N-(5-methyl-1H-pyrazol-3-yl)-1,3-thiazole-4-carboxamide
CID 47289778
2-acetamido-N-(1H-pyrazol-5-yl)propanamide
CID 61393558

Frequently Asked Questions

What is the IUPAC name of 2-acetamido-N-(5-methyl-1H-pyrazol-3-yl)propanamide?
The IUPAC name of 2-acetamido-N-(5-methyl-1H-pyrazol-3-yl)propanamide (CID 63819909) is 2-acetamido-N-(5-methyl-1H-pyrazol-3-yl)propanamide.
What is the SMILES notation for 2-acetamido-N-(5-methyl-1H-pyrazol-3-yl)propanamide?
The canonical SMILES for 2-acetamido-N-(5-methyl-1H-pyrazol-3-yl)propanamide is CC(=O)NC(C)C(=O)Nc1cc(C)[nH]n1.
What is the InChIKey of 2-acetamido-N-(5-methyl-1H-pyrazol-3-yl)propanamide?
The InChIKey is QCSJVXPSONMQLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4O2/c1-5-4-8(13-12-5)11-9(15)6(2)10-7(3)14/h4,6H,1-3H3,(H,10,14)(H2,11,12,13,15).
What are the key properties of 2-acetamido-N-(5-methyl-1H-pyrazol-3-yl)propanamide?
2-acetamido-N-(5-methyl-1H-pyrazol-3-yl)propanamide has a molecular weight of 210.24 g/mol, XLogP of 0.18, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-acetamido-N-(5-methyl-1H-pyrazol-3-yl)propanamide is sourced from PubChem (CID 63819909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).