4-amino-N-(1,2-oxazol-5-ylmethyl)-1H-pyrazole-5-carboxamide

C8H9N5O2 — CID 106413481

IUPAC4-amino-N-(1,2-oxazol-5-ylmethyl)-1H-pyrazole-5-carboxamide
SMILESNc1cn[nH]c1C(=O)NCc1ccno1
InChIInChI=1S/C8H9N5O2/c9-6-4-11-13-7(6)8(14)10-3-5-1-2-12-15-5/h1-2,4H,3,9H2,(H,10,14)(H,11,13)
InChIKeyMNAYAATXMORHEX-UHFFFAOYSA-N
MW207.19 g/mol
LogP-0.09
Rot. Bonds3

About 4-amino-N-(1,2-oxazol-5-ylmethyl)-1H-pyrazole-5-carboxamide

4-amino-N-(1,2-oxazol-5-ylmethyl)-1H-pyrazole-5-carboxamide (PubChem CID 106413481) has the molecular formula C8H9N5O2 and a molecular weight of 207.19 g/mol. Its IUPAC name is 4-amino-N-(1,2-oxazol-5-ylmethyl)-1H-pyrazole-5-carboxamide.

Molecular Properties

Compound Name4-amino-N-(1,2-oxazol-5-ylmethyl)-1H-pyrazole-5-carboxamide
PubChem CID106413481
Molecular FormulaC8H9N5O2
Molecular Weight207.19 g/mol
Exact Mass207.08
IUPAC Name4-amino-N-(1,2-oxazol-5-ylmethyl)-1H-pyrazole-5-carboxamide
SMILESNc1cn[nH]c1C(=O)NCc1ccno1
InChIInChI=1S/C8H9N5O2/c9-6-4-11-13-7(6)8(14)10-3-5-1-2-12-15-5/h1-2,4H,3,9H2,(H,10,14)(H,11,13)
InChIKeyMNAYAATXMORHEX-UHFFFAOYSA-N
XLogP-0.09
TPSA109.83 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.19
LogP ≤ 5-0.09
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

4-amino-N-(pyridin-4-ylmethyl)-1H-pyrazole-5-carboxamide
CID 63107423
2-amino-4,5-difluoro-N-(1,2-oxazol-5-ylmethyl)benzamide
CID 114185706
4-carbamothioyl-N-(1,2-oxazol-5-ylmethyl)benzamide
CID 114186280
3-amino-N-(1,2-oxazol-5-ylmethyl)benzamide
CID 106413441
4-amino-3-fluoro-N-(1,2-oxazol-5-ylmethyl)benzamide
CID 106413498
4-(1,2-oxazol-5-ylmethylcarbamoyl)benzoic acid
CID 106422079
N-(1,2-oxazol-5-ylmethyl)acetamide
CID 103939766
2-amino-3-fluoro-N-(1,2-oxazol-5-ylmethyl)pyridine-4-carboxamide
CID 106423000
2-amino-5-methyl-N-(1,2-oxazol-5-ylmethyl)benzamide
CID 114185707
2-(methylamino)-N-(1,2-oxazol-5-ylmethyl)benzamide
CID 106420098
3-fluoro-N-(1,2-oxazol-5-ylmethyl)pyridine-4-carboxamide
CID 104600458
3-amino-N-(1,2-oxazol-5-ylmethyl)thieno[2,3-b]pyridine-2-carboxamide
CID 106423442

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(1,2-oxazol-5-ylmethyl)-1H-pyrazole-5-carboxamide?
The IUPAC name of 4-amino-N-(1,2-oxazol-5-ylmethyl)-1H-pyrazole-5-carboxamide (CID 106413481) is 4-amino-N-(1,2-oxazol-5-ylmethyl)-1H-pyrazole-5-carboxamide.
What is the SMILES notation for 4-amino-N-(1,2-oxazol-5-ylmethyl)-1H-pyrazole-5-carboxamide?
The canonical SMILES for 4-amino-N-(1,2-oxazol-5-ylmethyl)-1H-pyrazole-5-carboxamide is Nc1cn[nH]c1C(=O)NCc1ccno1.
What is the InChIKey of 4-amino-N-(1,2-oxazol-5-ylmethyl)-1H-pyrazole-5-carboxamide?
The InChIKey is MNAYAATXMORHEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N5O2/c9-6-4-11-13-7(6)8(14)10-3-5-1-2-12-15-5/h1-2,4H,3,9H2,(H,10,14)(H,11,13).
What are the key properties of 4-amino-N-(1,2-oxazol-5-ylmethyl)-1H-pyrazole-5-carboxamide?
4-amino-N-(1,2-oxazol-5-ylmethyl)-1H-pyrazole-5-carboxamide has a molecular weight of 207.19 g/mol, XLogP of -0.09, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(1,2-oxazol-5-ylmethyl)-1H-pyrazole-5-carboxamide is sourced from PubChem (CID 106413481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).