N-(5-methyl-1,2-oxazol-3-yl)-1-phenyl-5-propylpyrazole-4-carboxamide

C17H18N4O2 — CID 2811261

IUPACN-(5-methyl-1,2-oxazol-3-yl)-1-phenyl-5-propylpyrazole-4-carboxamide
SMILESCCCc1c(C(=O)Nc2cc(C)on2)cnn1-c1ccccc1
InChIInChI=1S/C17H18N4O2/c1-3-7-15-14(17(22)19-16-10-12(2)23-20-16)11-18-21(15)13-8-5-4-6-9-13/h4-6,8-11H,3,7H2,1-2H3,(H,19,20,22)
InChIKeyTZHDPOLKAWZQLF-UHFFFAOYSA-N
MW310.36 g/mol
LogP3.37
Rot. Bonds5

About N-(5-methyl-1,2-oxazol-3-yl)-1-phenyl-5-propylpyrazole-4-carboxamide

N-(5-methyl-1,2-oxazol-3-yl)-1-phenyl-5-propylpyrazole-4-carboxamide (PubChem CID 2811261) has the molecular formula C17H18N4O2 and a molecular weight of 310.36 g/mol. Its IUPAC name is N-(5-methyl-1,2-oxazol-3-yl)-1-phenyl-5-propylpyrazole-4-carboxamide.

Molecular Properties

Compound NameN-(5-methyl-1,2-oxazol-3-yl)-1-phenyl-5-propylpyrazole-4-carboxamide
PubChem CID2811261
Molecular FormulaC17H18N4O2
Molecular Weight310.36 g/mol
Exact Mass310.14
IUPAC NameN-(5-methyl-1,2-oxazol-3-yl)-1-phenyl-5-propylpyrazole-4-carboxamide
SMILESCCCc1c(C(=O)Nc2cc(C)on2)cnn1-c1ccccc1
InChIInChI=1S/C17H18N4O2/c1-3-7-15-14(17(22)19-16-10-12(2)23-20-16)11-18-21(15)13-8-5-4-6-9-13/h4-6,8-11H,3,7H2,1-2H3,(H,19,20,22)
InChIKeyTZHDPOLKAWZQLF-UHFFFAOYSA-N
XLogP3.37
TPSA72.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.36
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-amino-N-[5-(isoxazol-3-ylcarbamoyl)-2-methylphenyl]-1-phenyl-1H-pyrazole-4-carboxamide
CID 46943424
5-amino-1-(2-fluorophenyl)-N-(5-(isoxazol-3-ylcarbamoyl)-2-methylphenyl)-1H-pyrazole-4-carboxamide
CID 49838879
5-(ethylamino)-N-(5-(isoxazol-3-ylcarbamoyl)-2-methylphenyl)-1-o-tolyl-1H-pyrazole-4-carboxamide
CID 52948828
N-[5-(tert-butyl)-3-isoxazolyl]-1-phenyl-5-propyl-1H-pyrazole-4-carboxamide
CID 2811417
5-amino-1-butyl-N-(5-(isoxazol-3-ylcarbamoyl)-2-methylphenyl)-1H-pyrazole-4-carboxamide
CID 52943885
5-amino-1-(4-fluorophenyl)-N-(5-(isoxazol-3-ylcarbamoyl)-2-methylphenyl)-1H-pyrazole-4-carboxamide
CID 52945031
5-isopropyl-N-[1-(4-methylbenzyl)-1H-pyrazol-3-yl]-3-isoxazolecarboxamide
CID 5308341
(5-methylisoxazol-3-yl)-N-{1-[(4-methylphenyl)methyl]pyrazol-3-yl}carboxamide
CID 9551033
N-(5-(isoxazol-3-ylcarbamoyl)-2-methylphenyl)-5-(methylamino)-1-phenyl-1H-pyrazole-4-carboxamide
CID 52943915
N-[1-[(4-methylphenyl)methyl]pyrazol-3-yl]-5-(2-methylpropyl)-1,2-oxazole-3-carboxamide
CID 5308157
N-[4-[4-(3-methyl-1,2,4-oxadiazol-5-yl)-5-(trifluoromethyl)pyrazol-1-yl]phenyl]hexanamide
CID 162676458
N-[1-(4-methylbenzyl)-1H-pyrazol-3-yl]-5-propylisoxazole-3-carboxamide
CID 16188850

Frequently Asked Questions

What is the IUPAC name of N-(5-methyl-1,2-oxazol-3-yl)-1-phenyl-5-propylpyrazole-4-carboxamide?
The IUPAC name of N-(5-methyl-1,2-oxazol-3-yl)-1-phenyl-5-propylpyrazole-4-carboxamide (CID 2811261) is N-(5-methyl-1,2-oxazol-3-yl)-1-phenyl-5-propylpyrazole-4-carboxamide.
What is the SMILES notation for N-(5-methyl-1,2-oxazol-3-yl)-1-phenyl-5-propylpyrazole-4-carboxamide?
The canonical SMILES for N-(5-methyl-1,2-oxazol-3-yl)-1-phenyl-5-propylpyrazole-4-carboxamide is CCCc1c(C(=O)Nc2cc(C)on2)cnn1-c1ccccc1.
What is the InChIKey of N-(5-methyl-1,2-oxazol-3-yl)-1-phenyl-5-propylpyrazole-4-carboxamide?
The InChIKey is TZHDPOLKAWZQLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N4O2/c1-3-7-15-14(17(22)19-16-10-12(2)23-20-16)11-18-21(15)13-8-5-4-6-9-13/h4-6,8-11H,3,7H2,1-2H3,(H,19,20,22).
What are the key properties of N-(5-methyl-1,2-oxazol-3-yl)-1-phenyl-5-propylpyrazole-4-carboxamide?
N-(5-methyl-1,2-oxazol-3-yl)-1-phenyl-5-propylpyrazole-4-carboxamide has a molecular weight of 310.36 g/mol, XLogP of 3.37, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-1,2-oxazol-3-yl)-1-phenyl-5-propylpyrazole-4-carboxamide is sourced from PubChem (CID 2811261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).