4-amino-1-ethyl-N-(1,2-oxazol-4-yl)pyrazole-3-carboxamide

C9H11N5O2 — CID 65358029

IUPAC4-amino-1-ethyl-N-(1,2-oxazol-4-yl)pyrazole-3-carboxamide
SMILESCCn1cc(N)c(C(=O)Nc2cnoc2)n1
InChIInChI=1S/C9H11N5O2/c1-2-14-4-7(10)8(13-14)9(15)12-6-3-11-16-5-6/h3-5H,2,10H2,1H3,(H,12,15)
InChIKeyKVNOFJIVWJSJDK-UHFFFAOYSA-N
MW221.22 g/mol
LogP0.73
Rot. Bonds3

About 4-amino-1-ethyl-N-(1,2-oxazol-4-yl)pyrazole-3-carboxamide

4-amino-1-ethyl-N-(1,2-oxazol-4-yl)pyrazole-3-carboxamide (PubChem CID 65358029) has the molecular formula C9H11N5O2 and a molecular weight of 221.22 g/mol. Its IUPAC name is 4-amino-1-ethyl-N-(1,2-oxazol-4-yl)pyrazole-3-carboxamide.

Molecular Properties

Compound Name4-amino-1-ethyl-N-(1,2-oxazol-4-yl)pyrazole-3-carboxamide
PubChem CID65358029
Molecular FormulaC9H11N5O2
Molecular Weight221.22 g/mol
Exact Mass221.09
IUPAC Name4-amino-1-ethyl-N-(1,2-oxazol-4-yl)pyrazole-3-carboxamide
SMILESCCn1cc(N)c(C(=O)Nc2cnoc2)n1
InChIInChI=1S/C9H11N5O2/c1-2-14-4-7(10)8(13-14)9(15)12-6-3-11-16-5-6/h3-5H,2,10H2,1H3,(H,12,15)
InChIKeyKVNOFJIVWJSJDK-UHFFFAOYSA-N
XLogP0.73
TPSA98.97 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.22
LogP ≤ 50.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

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CID 65359173
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CID 65358234
4-amino-1-ethyl-N-(2-hydroxyethyl)pyrazole-3-carboxamide
CID 65359089
4-amino-1-ethyl-N-(1-ethyl-3,5-dimethylpyrazol-4-yl)pyrazole-3-carboxamide
CID 19620454
4-amino-N-(2,6-dichlorophenyl)-1-ethylpyrazole-3-carboxamide
CID 65469816
4-amino-1-ethyl-N-(3-methyl-2-pyridinyl)pyrazole-3-carboxamide
CID 65359038
4-amino-1-ethyl-N-pentan-3-ylpyrazole-3-carboxamide
CID 65359220
4-amino-1-ethyl-N-(1,2,4-triazin-3-yl)pyrazole-3-carboxamide
CID 114386772
4-amino-1-ethyl-N-(2-hydroxy-2-methylpropyl)pyrazole-3-carboxamide
CID 65363321
4-amino-1-ethyl-N-(2-methylprop-2-enyl)pyrazole-3-carboxamide
CID 114615025
4-amino-1-ethyl-N-naphthalen-1-ylpyrazole-3-carboxamide
CID 65358599
4-amino-N-(4,6-dimethyl-2-pyridinyl)-1-ethylpyrazole-3-carboxamide
CID 114931708

Frequently Asked Questions

What is the IUPAC name of 4-amino-1-ethyl-N-(1,2-oxazol-4-yl)pyrazole-3-carboxamide?
The IUPAC name of 4-amino-1-ethyl-N-(1,2-oxazol-4-yl)pyrazole-3-carboxamide (CID 65358029) is 4-amino-1-ethyl-N-(1,2-oxazol-4-yl)pyrazole-3-carboxamide.
What is the SMILES notation for 4-amino-1-ethyl-N-(1,2-oxazol-4-yl)pyrazole-3-carboxamide?
The canonical SMILES for 4-amino-1-ethyl-N-(1,2-oxazol-4-yl)pyrazole-3-carboxamide is CCn1cc(N)c(C(=O)Nc2cnoc2)n1.
What is the InChIKey of 4-amino-1-ethyl-N-(1,2-oxazol-4-yl)pyrazole-3-carboxamide?
The InChIKey is KVNOFJIVWJSJDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N5O2/c1-2-14-4-7(10)8(13-14)9(15)12-6-3-11-16-5-6/h3-5H,2,10H2,1H3,(H,12,15).
What are the key properties of 4-amino-1-ethyl-N-(1,2-oxazol-4-yl)pyrazole-3-carboxamide?
4-amino-1-ethyl-N-(1,2-oxazol-4-yl)pyrazole-3-carboxamide has a molecular weight of 221.22 g/mol, XLogP of 0.73, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-1-ethyl-N-(1,2-oxazol-4-yl)pyrazole-3-carboxamide is sourced from PubChem (CID 65358029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).