N-(1,3-dimethyl-5-pyridin-3-yloxypyrazol-4-yl)-5-propan-2-yl-1,2-oxazole-3-carboxamide

C17H19N5O3 — CID 86781581

IUPACN-(1,3-dimethyl-5-pyridin-3-yloxypyrazol-4-yl)-5-propan-2-yl-1,2-oxazole-3-carboxamide
SMILESCc1nn(C)c(Oc2cccnc2)c1NC(=O)c1cc(C(C)C)on1
InChIInChI=1S/C17H19N5O3/c1-10(2)14-8-13(21-25-14)16(23)19-15-11(3)20-22(4)17(15)24-12-6-5-7-18-9-12/h5-10H,1-4H3,(H,19,23)
InChIKeyWITFDZNRKSTTJQ-UHFFFAOYSA-N
MW341.37 g/mol
LogP3.28
Rot. Bonds5

About N-(1,3-dimethyl-5-pyridin-3-yloxypyrazol-4-yl)-5-propan-2-yl-1,2-oxazole-3-carboxamide

N-(1,3-dimethyl-5-pyridin-3-yloxypyrazol-4-yl)-5-propan-2-yl-1,2-oxazole-3-carboxamide (PubChem CID 86781581) has the molecular formula C17H19N5O3 and a molecular weight of 341.37 g/mol. Its IUPAC name is N-(1,3-dimethyl-5-pyridin-3-yloxypyrazol-4-yl)-5-propan-2-yl-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-(1,3-dimethyl-5-pyridin-3-yloxypyrazol-4-yl)-5-propan-2-yl-1,2-oxazole-3-carboxamide
PubChem CID86781581
Molecular FormulaC17H19N5O3
Molecular Weight341.37 g/mol
Exact Mass341.15
IUPAC NameN-(1,3-dimethyl-5-pyridin-3-yloxypyrazol-4-yl)-5-propan-2-yl-1,2-oxazole-3-carboxamide
SMILESCc1nn(C)c(Oc2cccnc2)c1NC(=O)c1cc(C(C)C)on1
InChIInChI=1S/C17H19N5O3/c1-10(2)14-8-13(21-25-14)16(23)19-15-11(3)20-22(4)17(15)24-12-6-5-7-18-9-12/h5-10H,1-4H3,(H,19,23)
InChIKeyWITFDZNRKSTTJQ-UHFFFAOYSA-N
XLogP3.28
TPSA95.07 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.37
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

4-nitro-N-[3-nitro-5-(3-pyridinyloxy)phenyl]-1-methyl-1H-pyrazole-3-carboxamide
CID 3115024
N-methyl-5-[(6-methyl-3-pyridyl)oxymethyl]-N-[[1-(o-tolyl)pyrazol-4-yl]methyl]isoxazole-3-carboxamide
CID 24790337
5-[(5-chloro-3-pyridinyl)oxymethyl]-N-[(1-ethyl-3,5-dimethylpyrazol-4-yl)methyl]-1,2-oxazole-3-carboxamide
CID 24791808
N-[[1-(3-fluorophenyl)pyrazol-4-yl]methyl]-5-[(6-methyl-3-pyridinyl)oxymethyl]-1,2-oxazole-3-carboxamide
CID 24817788
N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-6-methoxypyridine-2-carboxamide
CID 155518895
N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-5-methoxypyridine-3-carboxamide
CID 155524757
N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2-methyl-1,3-benzoxazole-6-carboxamide
CID 57422311
5-methoxy-N-[5-[[6-(2-pyrrolidin-1-ylethoxy)-3-pyridinyl]carbamoyl]-1H-pyrazol-4-yl]pyridine-3-carboxamide
CID 154654243
N-[(1-ethyl-3,5-dimethylpyrazol-4-yl)methyl]-5-[(6-methyl-3-pyridinyl)oxymethyl]-1,2-oxazole-3-carboxamide
CID 24794143
N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-2-methoxypyridine-3-carboxamide
CID 155565412
5-prop-1-en-2-yl-N-[1-[[4-(trifluoromethyl)pyridin-3-yl]methyl]pyrazol-4-yl]-1,2-oxazole-3-carboxamide
CID 146220534
5-propan-2-yl-N-[1-[[4-(trifluoromethyl)pyridin-3-yl]methyl]pyrazol-4-yl]-1,2-oxazole-3-carboxamide
CID 146220599

Frequently Asked Questions

What is the IUPAC name of N-(1,3-dimethyl-5-pyridin-3-yloxypyrazol-4-yl)-5-propan-2-yl-1,2-oxazole-3-carboxamide?
The IUPAC name of N-(1,3-dimethyl-5-pyridin-3-yloxypyrazol-4-yl)-5-propan-2-yl-1,2-oxazole-3-carboxamide (CID 86781581) is N-(1,3-dimethyl-5-pyridin-3-yloxypyrazol-4-yl)-5-propan-2-yl-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-(1,3-dimethyl-5-pyridin-3-yloxypyrazol-4-yl)-5-propan-2-yl-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-(1,3-dimethyl-5-pyridin-3-yloxypyrazol-4-yl)-5-propan-2-yl-1,2-oxazole-3-carboxamide is Cc1nn(C)c(Oc2cccnc2)c1NC(=O)c1cc(C(C)C)on1.
What is the InChIKey of N-(1,3-dimethyl-5-pyridin-3-yloxypyrazol-4-yl)-5-propan-2-yl-1,2-oxazole-3-carboxamide?
The InChIKey is WITFDZNRKSTTJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N5O3/c1-10(2)14-8-13(21-25-14)16(23)19-15-11(3)20-22(4)17(15)24-12-6-5-7-18-9-12/h5-10H,1-4H3,(H,19,23).
What are the key properties of N-(1,3-dimethyl-5-pyridin-3-yloxypyrazol-4-yl)-5-propan-2-yl-1,2-oxazole-3-carboxamide?
N-(1,3-dimethyl-5-pyridin-3-yloxypyrazol-4-yl)-5-propan-2-yl-1,2-oxazole-3-carboxamide has a molecular weight of 341.37 g/mol, XLogP of 3.28, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,3-dimethyl-5-pyridin-3-yloxypyrazol-4-yl)-5-propan-2-yl-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 86781581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).