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

C11H15N5O — CID 112689328

IUPACN-(4,5-dimethyl-1H-pyrazol-3-yl)-3-pyrazol-1-ylpropanamide
SMILESCc1[nH]nc(NC(=O)CCn2cccn2)c1C
InChIInChI=1S/C11H15N5O/c1-8-9(2)14-15-11(8)13-10(17)4-7-16-6-3-5-12-16/h3,5-6H,4,7H2,1-2H3,(H2,13,14,15,17)
InChIKeyMGPQAQGAGLUOOT-UHFFFAOYSA-N
MW233.28 g/mol
LogP1.25
Rot. Bonds4

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

N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-pyrazol-1-ylpropanamide (PubChem CID 112689328) has the molecular formula C11H15N5O and a molecular weight of 233.28 g/mol. Its IUPAC name is N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-pyrazol-1-ylpropanamide.

Molecular Properties

Compound NameN-(4,5-dimethyl-1H-pyrazol-3-yl)-3-pyrazol-1-ylpropanamide
PubChem CID112689328
Molecular FormulaC11H15N5O
Molecular Weight233.28 g/mol
Exact Mass233.13
IUPAC NameN-(4,5-dimethyl-1H-pyrazol-3-yl)-3-pyrazol-1-ylpropanamide
SMILESCc1[nH]nc(NC(=O)CCn2cccn2)c1C
InChIInChI=1S/C11H15N5O/c1-8-9(2)14-15-11(8)13-10(17)4-7-16-6-3-5-12-16/h3,5-6H,4,7H2,1-2H3,(H2,13,14,15,17)
InChIKeyMGPQAQGAGLUOOT-UHFFFAOYSA-N
XLogP1.25
TPSA75.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.28
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3,5-dimethyl-1H-pyrazol-4-yl)-3-pyrazol-1-ylpropanamide
CID 43546402
N-(4,5-dimethyl-1H-pyrazol-3-yl)-2-(2-oxo-1-pyridinyl)acetamide
CID 86848927
3-pyrazol-1-yl-N-(1H-1,2,4-triazol-5-yl)propanamide
CID 61216623
N-(1,3-dimethylpyrazol-4-yl)-3-pyrazol-1-ylpropanamide
CID 134704539
2-chloro-N-(4,5-dimethyl-1H-pyrazol-3-yl)acetamide
CID 104617747
N-(3-bromo-5-methylphenyl)-3-pyrazol-1-ylpropanamide
CID 104939286
3-methyl-5-(3-pyrazol-1-ylpropanoylamino)-1,2-thiazole-4-carboxylic acid
CID 60868636
N-(3-chloroquinoxalin-2-yl)-3-pyrazol-1-ylpropanamide
CID 102989766
N-(4,5-dimethyl-1H-pyrazol-3-yl)-2-pyridin-2-ylacetamide
CID 104620045
N-(2-bromo-5-methylphenyl)-3-pyrazol-1-ylpropanamide
CID 82757585
6-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)-4,4-dimethylhexanamide
CID 104618745
5-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)hexanamide
CID 104618844

Frequently Asked Questions

What is the IUPAC name of N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-pyrazol-1-ylpropanamide?
The IUPAC name of N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-pyrazol-1-ylpropanamide (CID 112689328) is N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-pyrazol-1-ylpropanamide.
What is the SMILES notation for N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-pyrazol-1-ylpropanamide?
The canonical SMILES for N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-pyrazol-1-ylpropanamide is Cc1[nH]nc(NC(=O)CCn2cccn2)c1C.
What is the InChIKey of N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-pyrazol-1-ylpropanamide?
The InChIKey is MGPQAQGAGLUOOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5O/c1-8-9(2)14-15-11(8)13-10(17)4-7-16-6-3-5-12-16/h3,5-6H,4,7H2,1-2H3,(H2,13,14,15,17).
What are the key properties of N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-pyrazol-1-ylpropanamide?
N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-pyrazol-1-ylpropanamide has a molecular weight of 233.28 g/mol, XLogP of 1.25, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-pyrazol-1-ylpropanamide is sourced from PubChem (CID 112689328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).