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

C8H13N3O2 — CID 126991153

IUPACN-(3,5-dimethyl-1H-pyrazol-4-yl)-2-hydroxypropanamide
SMILESCc1n[nH]c(C)c1NC(=O)C(C)O
InChIInChI=1S/C8H13N3O2/c1-4-7(5(2)11-10-4)9-8(13)6(3)12/h6,12H,1-3H3,(H,9,13)(H,10,11)
InChIKeyXJNXTXOKWRSTOI-UHFFFAOYSA-N
MW183.21 g/mol
LogP0.35
Rot. Bonds2

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

N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-hydroxypropanamide (PubChem CID 126991153) has the molecular formula C8H13N3O2 and a molecular weight of 183.21 g/mol. Its IUPAC name is N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-hydroxypropanamide.

Molecular Properties

Compound NameN-(3,5-dimethyl-1H-pyrazol-4-yl)-2-hydroxypropanamide
PubChem CID126991153
Molecular FormulaC8H13N3O2
Molecular Weight183.21 g/mol
Exact Mass183.10
IUPAC NameN-(3,5-dimethyl-1H-pyrazol-4-yl)-2-hydroxypropanamide
SMILESCc1n[nH]c(C)c1NC(=O)C(C)O
InChIInChI=1S/C8H13N3O2/c1-4-7(5(2)11-10-4)9-8(13)6(3)12/h6,12H,1-3H3,(H,9,13)(H,10,11)
InChIKeyXJNXTXOKWRSTOI-UHFFFAOYSA-N
XLogP0.35
TPSA78.01 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.21
LogP ≤ 50.35
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)propanamide
CID 43547720
N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-methylbutanamide
CID 43546964
(2R,3R)-2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-3-methylpentanamide
CID 93240679
3-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-methylpropanamide;dihydrochloride
CID 54592690
2-cyclopropyl-N-(3,5-dimethyl-1H-pyrazol-4-yl)propanamide
CID 79506566
N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-propan-2-yloxyacetamide
CID 112687011
N-(3,5-dimethyl-1H-pyrazol-4-yl)-3,5-dimethyl-1H-pyrazole-4-carboxamide
CID 43582921
N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-[2-(4-fluoroanilino)-2-oxoethyl]sulfanylpropanamide
CID 86847428
2-hydroxy-N-(5-methyl-1H-pyrazol-3-yl)propanamide
CID 117099978
1-tert-butyl-3-(3,5-dimethyl-1H-pyrazol-4-yl)urea
CID 43547022
2-hydroxy-N-(2,3,4,5,6-pentamethylphenyl)propanamide
CID 91336330
N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-(2-fluorophenoxy)propanamide
CID 43546883

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-hydroxypropanamide?
The IUPAC name of N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-hydroxypropanamide (CID 126991153) is N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-hydroxypropanamide.
What is the SMILES notation for N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-hydroxypropanamide?
The canonical SMILES for N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-hydroxypropanamide is Cc1n[nH]c(C)c1NC(=O)C(C)O.
What is the InChIKey of N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-hydroxypropanamide?
The InChIKey is XJNXTXOKWRSTOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3O2/c1-4-7(5(2)11-10-4)9-8(13)6(3)12/h6,12H,1-3H3,(H,9,13)(H,10,11).
What are the key properties of N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-hydroxypropanamide?
N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-hydroxypropanamide has a molecular weight of 183.21 g/mol, XLogP of 0.35, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-hydroxypropanamide is sourced from PubChem (CID 126991153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).