3-methyl-N-(1H-pyrazol-4-yl)-1,2-oxazole-5-carboxamide

C8H8N4O2 — CID 43429619

IUPAC3-methyl-N-(1H-pyrazol-4-yl)-1,2-oxazole-5-carboxamide
SMILESCc1cc(C(=O)Nc2cn[nH]c2)on1
InChIInChI=1S/C8H8N4O2/c1-5-2-7(14-12-5)8(13)11-6-3-9-10-4-6/h2-4H,1H3,(H,9,10)(H,11,13)
InChIKeyKTVPCGMFDRYTGW-UHFFFAOYSA-N
MW192.18 g/mol
LogP0.96
Rot. Bonds2

About 3-methyl-N-(1H-pyrazol-4-yl)-1,2-oxazole-5-carboxamide

3-methyl-N-(1H-pyrazol-4-yl)-1,2-oxazole-5-carboxamide (PubChem CID 43429619) has the molecular formula C8H8N4O2 and a molecular weight of 192.18 g/mol. Its IUPAC name is 3-methyl-N-(1H-pyrazol-4-yl)-1,2-oxazole-5-carboxamide.

Molecular Properties

Compound Name3-methyl-N-(1H-pyrazol-4-yl)-1,2-oxazole-5-carboxamide
PubChem CID43429619
Molecular FormulaC8H8N4O2
Molecular Weight192.18 g/mol
Exact Mass192.06
IUPAC Name3-methyl-N-(1H-pyrazol-4-yl)-1,2-oxazole-5-carboxamide
SMILESCc1cc(C(=O)Nc2cn[nH]c2)on1
InChIInChI=1S/C8H8N4O2/c1-5-2-7(14-12-5)8(13)11-6-3-9-10-4-6/h2-4H,1H3,(H,9,10)(H,11,13)
InChIKeyKTVPCGMFDRYTGW-UHFFFAOYSA-N
XLogP0.96
TPSA83.81 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.18
LogP ≤ 50.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(1H-pyrazol-4-ylcarbamoyl)-1,2-oxazole-5-carboxylic acid
CID 107369215
3-methyl-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-1,2-oxazole-5-carboxamide
CID 26017452
4-methyl-N-(1H-pyrazol-4-yl)-1,2-oxazole-5-carboxamide
CID 66335411
3,6-dimethyl-N-(1H-pyrazol-4-yl)pyridazine-4-carboxamide
CID 115875480
N-(4-carbamoylphenyl)-3-methyl-1,2-oxazole-5-carboxamide
CID 21432228
N-(4-benzamidophenyl)-3-methyl-1,2-oxazole-5-carboxamide
CID 43911460
3-methyl-N-(4-methylsulfanylphenyl)-1,2-oxazole-5-carboxamide
CID 16880199
N-[4-(aminomethyl)phenyl]-3-methyl-1,2-oxazole-5-carboxamide
CID 104954922
1H-pyrazol-4-ylcarbamic acid
CID 66846919
1H-pyrazol-4-ylcarbamic acid
CID 66846920
N-(3-fluorophenyl)-3-methyl-1,2-oxazole-5-carboxamide
CID 16606648
N-(1,3-dioxoisoindol-5-yl)-3-methyl-1,2-oxazole-5-carboxamide
CID 16880187

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(1H-pyrazol-4-yl)-1,2-oxazole-5-carboxamide?
The IUPAC name of 3-methyl-N-(1H-pyrazol-4-yl)-1,2-oxazole-5-carboxamide (CID 43429619) is 3-methyl-N-(1H-pyrazol-4-yl)-1,2-oxazole-5-carboxamide.
What is the SMILES notation for 3-methyl-N-(1H-pyrazol-4-yl)-1,2-oxazole-5-carboxamide?
The canonical SMILES for 3-methyl-N-(1H-pyrazol-4-yl)-1,2-oxazole-5-carboxamide is Cc1cc(C(=O)Nc2cn[nH]c2)on1.
What is the InChIKey of 3-methyl-N-(1H-pyrazol-4-yl)-1,2-oxazole-5-carboxamide?
The InChIKey is KTVPCGMFDRYTGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N4O2/c1-5-2-7(14-12-5)8(13)11-6-3-9-10-4-6/h2-4H,1H3,(H,9,10)(H,11,13).
What are the key properties of 3-methyl-N-(1H-pyrazol-4-yl)-1,2-oxazole-5-carboxamide?
3-methyl-N-(1H-pyrazol-4-yl)-1,2-oxazole-5-carboxamide has a molecular weight of 192.18 g/mol, XLogP of 0.96, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(1H-pyrazol-4-yl)-1,2-oxazole-5-carboxamide is sourced from PubChem (CID 43429619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).