4-amino-N-(1,2-oxazol-3-yl)-1H-pyrrole-2-carboxamide

C8H8N4O2 — CID 62903283

IUPAC4-amino-N-(1,2-oxazol-3-yl)-1H-pyrrole-2-carboxamide
SMILESNc1c[nH]c(C(=O)Nc2ccon2)c1
InChIInChI=1S/C8H8N4O2/c9-5-3-6(10-4-5)8(13)11-7-1-2-14-12-7/h1-4,10H,9H2,(H,11,12,13)
InChIKeyONNULCLABWDNOM-UHFFFAOYSA-N
MW192.18 g/mol
LogP0.84
Rot. Bonds2

About 4-amino-N-(1,2-oxazol-3-yl)-1H-pyrrole-2-carboxamide

4-amino-N-(1,2-oxazol-3-yl)-1H-pyrrole-2-carboxamide (PubChem CID 62903283) has the molecular formula C8H8N4O2 and a molecular weight of 192.18 g/mol. Its IUPAC name is 4-amino-N-(1,2-oxazol-3-yl)-1H-pyrrole-2-carboxamide.

Molecular Properties

Compound Name4-amino-N-(1,2-oxazol-3-yl)-1H-pyrrole-2-carboxamide
PubChem CID62903283
Molecular FormulaC8H8N4O2
Molecular Weight192.18 g/mol
Exact Mass192.06
IUPAC Name4-amino-N-(1,2-oxazol-3-yl)-1H-pyrrole-2-carboxamide
SMILESNc1c[nH]c(C(=O)Nc2ccon2)c1
InChIInChI=1S/C8H8N4O2/c9-5-3-6(10-4-5)8(13)11-7-1-2-14-12-7/h1-4,10H,9H2,(H,11,12,13)
InChIKeyONNULCLABWDNOM-UHFFFAOYSA-N
XLogP0.84
TPSA96.94 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.18
LogP ≤ 50.84
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(1,2-oxazol-3-yl)-1H-pyrrole-2-carboxamide?
The IUPAC name of 4-amino-N-(1,2-oxazol-3-yl)-1H-pyrrole-2-carboxamide (CID 62903283) is 4-amino-N-(1,2-oxazol-3-yl)-1H-pyrrole-2-carboxamide.
What is the SMILES notation for 4-amino-N-(1,2-oxazol-3-yl)-1H-pyrrole-2-carboxamide?
The canonical SMILES for 4-amino-N-(1,2-oxazol-3-yl)-1H-pyrrole-2-carboxamide is Nc1c[nH]c(C(=O)Nc2ccon2)c1.
What is the InChIKey of 4-amino-N-(1,2-oxazol-3-yl)-1H-pyrrole-2-carboxamide?
The InChIKey is ONNULCLABWDNOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N4O2/c9-5-3-6(10-4-5)8(13)11-7-1-2-14-12-7/h1-4,10H,9H2,(H,11,12,13).
What are the key properties of 4-amino-N-(1,2-oxazol-3-yl)-1H-pyrrole-2-carboxamide?
4-amino-N-(1,2-oxazol-3-yl)-1H-pyrrole-2-carboxamide has a molecular weight of 192.18 g/mol, XLogP of 0.84, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(1,2-oxazol-3-yl)-1H-pyrrole-2-carboxamide is sourced from PubChem (CID 62903283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).