5-ethyl-N-(4-ethylphenyl)-1-(6-methoxypyridazin-3-yl)pyrazole-4-carboxamide

C19H21N5O2 — CID 31901378

IUPAC5-ethyl-N-(4-ethylphenyl)-1-(6-methoxypyridazin-3-yl)pyrazole-4-carboxamide
SMILESCCc1ccc(NC(=O)c2cnn(-c3ccc(OC)nn3)c2CC)cc1
InChIInChI=1S/C19H21N5O2/c1-4-13-6-8-14(9-7-13)21-19(25)15-12-20-24(16(15)5-2)17-10-11-18(26-3)23-22-17/h6-12H,4-5H2,1-3H3,(H,21,25)
InChIKeyVUGYSPRVCDLTRP-UHFFFAOYSA-N
MW351.41 g/mol
LogP3.05
Rot. Bonds6

About 5-ethyl-N-(4-ethylphenyl)-1-(6-methoxypyridazin-3-yl)pyrazole-4-carboxamide

5-ethyl-N-(4-ethylphenyl)-1-(6-methoxypyridazin-3-yl)pyrazole-4-carboxamide (PubChem CID 31901378) has the molecular formula C19H21N5O2 and a molecular weight of 351.41 g/mol. Its IUPAC name is 5-ethyl-N-(4-ethylphenyl)-1-(6-methoxypyridazin-3-yl)pyrazole-4-carboxamide.

Molecular Properties

Compound Name5-ethyl-N-(4-ethylphenyl)-1-(6-methoxypyridazin-3-yl)pyrazole-4-carboxamide
PubChem CID31901378
Molecular FormulaC19H21N5O2
Molecular Weight351.41 g/mol
Exact Mass351.17
IUPAC Name5-ethyl-N-(4-ethylphenyl)-1-(6-methoxypyridazin-3-yl)pyrazole-4-carboxamide
SMILESCCc1ccc(NC(=O)c2cnn(-c3ccc(OC)nn3)c2CC)cc1
InChIInChI=1S/C19H21N5O2/c1-4-13-6-8-14(9-7-13)21-19(25)15-12-20-24(16(15)5-2)17-10-11-18(26-3)23-22-17/h6-12H,4-5H2,1-3H3,(H,21,25)
InChIKeyVUGYSPRVCDLTRP-UHFFFAOYSA-N
XLogP3.05
TPSA81.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.41
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

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CID 4298774
1-(2-ethylphenyl)-N-(4-methoxyphenyl)-5-methyl-1H-pyrazole-4-carboxamide
CID 1235420
5-(4-methoxyphenethyl)-6-methyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4(5H)-one
CID 2033978
1-(3,4-Dimethylphenyl)-5-(4-methoxyphenyl)-6-methyl-1H,4H,5H-pyrazolo[3,4-D]pyrimidin-4-one
CID 5307766
5-(4-methoxyphenethyl)-1-(p-tolyl)-1H-pyrazolo[3,4-d]pyrimidin-4(5H)-one
CID 8031490
5-(4-methoxyphenyl)-6-methyl-1-(4-methylphenyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
CID 16194421
1-(4-methoxyphenyl)-5-methyl-N-[4-(trifluoromethyl)phenyl]pyrazole-4-carboxamide
CID 44327058
6-[(E)-2-[2-(difluoromethoxy)phenyl]ethenyl]-1-phenyl-5H-pyrazolo[5,4-d]pyrimidin-4-one
CID 135401286
6-[(E)-2-(3-methoxyphenyl)ethenyl]-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-one
CID 135433200
6-[(E)-2-[4-(difluoromethoxy)phenyl]ethenyl]-1-phenyl-5H-pyrazolo[5,4-d]pyrimidin-4-one
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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-N-(4-ethylphenyl)-1-(6-methoxypyridazin-3-yl)pyrazole-4-carboxamide?
The IUPAC name of 5-ethyl-N-(4-ethylphenyl)-1-(6-methoxypyridazin-3-yl)pyrazole-4-carboxamide (CID 31901378) is 5-ethyl-N-(4-ethylphenyl)-1-(6-methoxypyridazin-3-yl)pyrazole-4-carboxamide.
What is the SMILES notation for 5-ethyl-N-(4-ethylphenyl)-1-(6-methoxypyridazin-3-yl)pyrazole-4-carboxamide?
The canonical SMILES for 5-ethyl-N-(4-ethylphenyl)-1-(6-methoxypyridazin-3-yl)pyrazole-4-carboxamide is CCc1ccc(NC(=O)c2cnn(-c3ccc(OC)nn3)c2CC)cc1.
What is the InChIKey of 5-ethyl-N-(4-ethylphenyl)-1-(6-methoxypyridazin-3-yl)pyrazole-4-carboxamide?
The InChIKey is VUGYSPRVCDLTRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N5O2/c1-4-13-6-8-14(9-7-13)21-19(25)15-12-20-24(16(15)5-2)17-10-11-18(26-3)23-22-17/h6-12H,4-5H2,1-3H3,(H,21,25).
What are the key properties of 5-ethyl-N-(4-ethylphenyl)-1-(6-methoxypyridazin-3-yl)pyrazole-4-carboxamide?
5-ethyl-N-(4-ethylphenyl)-1-(6-methoxypyridazin-3-yl)pyrazole-4-carboxamide has a molecular weight of 351.41 g/mol, XLogP of 3.05, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-N-(4-ethylphenyl)-1-(6-methoxypyridazin-3-yl)pyrazole-4-carboxamide is sourced from PubChem (CID 31901378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).