3-cyclopropyl-N,1-dimethyl-N-pyridazin-4-ylpyrazole-4-carboxamide

C13H15N5O — CID 59607144

IUPAC3-cyclopropyl-N,1-dimethyl-N-pyridazin-4-ylpyrazole-4-carboxamide
SMILESCN(C(=O)c1cn(C)nc1C1CC1)c1ccnnc1
InChIInChI=1S/C13H15N5O/c1-17-8-11(12(16-17)9-3-4-9)13(19)18(2)10-5-6-14-15-7-10/h5-9H,3-4H2,1-2H3
InChIKeyNSLDJHMHZNIBOW-UHFFFAOYSA-N
MW257.30 g/mol
LogP1.36
Rot. Bonds3

About 3-cyclopropyl-N,1-dimethyl-N-pyridazin-4-ylpyrazole-4-carboxamide

3-cyclopropyl-N,1-dimethyl-N-pyridazin-4-ylpyrazole-4-carboxamide (PubChem CID 59607144) has the molecular formula C13H15N5O and a molecular weight of 257.30 g/mol. Its IUPAC name is 3-cyclopropyl-N,1-dimethyl-N-pyridazin-4-ylpyrazole-4-carboxamide.

Molecular Properties

Compound Name3-cyclopropyl-N,1-dimethyl-N-pyridazin-4-ylpyrazole-4-carboxamide
PubChem CID59607144
Molecular FormulaC13H15N5O
Molecular Weight257.30 g/mol
Exact Mass257.13
IUPAC Name3-cyclopropyl-N,1-dimethyl-N-pyridazin-4-ylpyrazole-4-carboxamide
SMILESCN(C(=O)c1cn(C)nc1C1CC1)c1ccnnc1
InChIInChI=1S/C13H15N5O/c1-17-8-11(12(16-17)9-3-4-9)13(19)18(2)10-5-6-14-15-7-10/h5-9H,3-4H2,1-2H3
InChIKeyNSLDJHMHZNIBOW-UHFFFAOYSA-N
XLogP1.36
TPSA63.91 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.30
LogP ≤ 51.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-N,1-dimethyl-N-pyridazin-4-ylpyrazole-4-carboxamide?
The IUPAC name of 3-cyclopropyl-N,1-dimethyl-N-pyridazin-4-ylpyrazole-4-carboxamide (CID 59607144) is 3-cyclopropyl-N,1-dimethyl-N-pyridazin-4-ylpyrazole-4-carboxamide.
What is the SMILES notation for 3-cyclopropyl-N,1-dimethyl-N-pyridazin-4-ylpyrazole-4-carboxamide?
The canonical SMILES for 3-cyclopropyl-N,1-dimethyl-N-pyridazin-4-ylpyrazole-4-carboxamide is CN(C(=O)c1cn(C)nc1C1CC1)c1ccnnc1.
What is the InChIKey of 3-cyclopropyl-N,1-dimethyl-N-pyridazin-4-ylpyrazole-4-carboxamide?
The InChIKey is NSLDJHMHZNIBOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N5O/c1-17-8-11(12(16-17)9-3-4-9)13(19)18(2)10-5-6-14-15-7-10/h5-9H,3-4H2,1-2H3.
What are the key properties of 3-cyclopropyl-N,1-dimethyl-N-pyridazin-4-ylpyrazole-4-carboxamide?
3-cyclopropyl-N,1-dimethyl-N-pyridazin-4-ylpyrazole-4-carboxamide has a molecular weight of 257.30 g/mol, XLogP of 1.36, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-N,1-dimethyl-N-pyridazin-4-ylpyrazole-4-carboxamide is sourced from PubChem (CID 59607144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).