N-(1,3-dimethylpyrazol-4-yl)-3-pyrazol-1-ylpropanamide

C11H15N5O — CID 134704539

IUPACN-(1,3-dimethylpyrazol-4-yl)-3-pyrazol-1-ylpropanamide
SMILESCc1nn(C)cc1NC(=O)CCn1cccn1
InChIInChI=1S/C11H15N5O/c1-9-10(8-15(2)14-9)13-11(17)4-7-16-6-3-5-12-16/h3,5-6,8H,4,7H2,1-2H3,(H,13,17)
InChIKeyOKEBLQKCHWJQPE-UHFFFAOYSA-N
MW233.28 g/mol
LogP0.95
Rot. Bonds4

About N-(1,3-dimethylpyrazol-4-yl)-3-pyrazol-1-ylpropanamide

N-(1,3-dimethylpyrazol-4-yl)-3-pyrazol-1-ylpropanamide (PubChem CID 134704539) has the molecular formula C11H15N5O and a molecular weight of 233.28 g/mol. Its IUPAC name is N-(1,3-dimethylpyrazol-4-yl)-3-pyrazol-1-ylpropanamide.

Molecular Properties

Compound NameN-(1,3-dimethylpyrazol-4-yl)-3-pyrazol-1-ylpropanamide
PubChem CID134704539
Molecular FormulaC11H15N5O
Molecular Weight233.28 g/mol
Exact Mass233.13
IUPAC NameN-(1,3-dimethylpyrazol-4-yl)-3-pyrazol-1-ylpropanamide
SMILESCc1nn(C)cc1NC(=O)CCn1cccn1
InChIInChI=1S/C11H15N5O/c1-9-10(8-15(2)14-9)13-11(17)4-7-16-6-3-5-12-16/h3,5-6,8H,4,7H2,1-2H3,(H,13,17)
InChIKeyOKEBLQKCHWJQPE-UHFFFAOYSA-N
XLogP0.95
TPSA64.74 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.28
LogP ≤ 50.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(1,3-dimethylpyrazol-4-yl)-4-oxopentanamide
CID 102805637
N-(1,3-dimethylpyrazol-4-yl)-2-sulfanylacetamide
CID 102807672
N-(2-bromo-5-methylphenyl)-3-pyrazol-1-ylpropanamide
CID 82757585
N-(1,3-dimethylpyrazol-4-yl)-2-(propylamino)acetamide
CID 102805551
N-(3,5-dimethyl-1H-pyrazol-4-yl)-3-pyrazol-1-ylpropanamide
CID 43546402
2-(3-pyrazol-1-ylpropanoylamino)benzoic acid
CID 28788711
N-(5-bromo-4-fluoro-2-methylphenyl)-3-pyrazol-1-ylpropanamide
CID 99832953
N-(2-methoxy-5-methylphenyl)-3-pyrazol-1-ylpropanamide
CID 46339335
N-[2-(ethylaminomethyl)phenyl]-3-pyrazol-1-ylpropanamide;dihydrochloride
CID 119439339
N-[2-(methylaminomethyl)phenyl]-3-pyrazol-1-ylpropanamide;dihydrochloride
CID 119437899
N-(3-bromo-5-methylphenyl)-3-pyrazol-1-ylpropanamide
CID 104939286
N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-pyrazol-1-ylpropanamide
CID 112689328

Frequently Asked Questions

What is the IUPAC name of N-(1,3-dimethylpyrazol-4-yl)-3-pyrazol-1-ylpropanamide?
The IUPAC name of N-(1,3-dimethylpyrazol-4-yl)-3-pyrazol-1-ylpropanamide (CID 134704539) is N-(1,3-dimethylpyrazol-4-yl)-3-pyrazol-1-ylpropanamide.
What is the SMILES notation for N-(1,3-dimethylpyrazol-4-yl)-3-pyrazol-1-ylpropanamide?
The canonical SMILES for N-(1,3-dimethylpyrazol-4-yl)-3-pyrazol-1-ylpropanamide is Cc1nn(C)cc1NC(=O)CCn1cccn1.
What is the InChIKey of N-(1,3-dimethylpyrazol-4-yl)-3-pyrazol-1-ylpropanamide?
The InChIKey is OKEBLQKCHWJQPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5O/c1-9-10(8-15(2)14-9)13-11(17)4-7-16-6-3-5-12-16/h3,5-6,8H,4,7H2,1-2H3,(H,13,17).
What are the key properties of N-(1,3-dimethylpyrazol-4-yl)-3-pyrazol-1-ylpropanamide?
N-(1,3-dimethylpyrazol-4-yl)-3-pyrazol-1-ylpropanamide has a molecular weight of 233.28 g/mol, XLogP of 0.95, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,3-dimethylpyrazol-4-yl)-3-pyrazol-1-ylpropanamide is sourced from PubChem (CID 134704539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).