4-amino-1-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]pyrrole-2-carboxamide

C15H14N4O2 — CID 61102969

IUPAC4-amino-1-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]pyrrole-2-carboxamide
SMILESCn1cc(N)cc1C(=O)Nc1cccc(-c2cnco2)c1
InChIInChI=1S/C15H14N4O2/c1-19-8-11(16)6-13(19)15(20)18-12-4-2-3-10(5-12)14-7-17-9-21-14/h2-9H,16H2,1H3,(H,18,20)
InChIKeyFEANWBDDBPMHRB-UHFFFAOYSA-N
MW282.30 g/mol
LogP2.51
Rot. Bonds3

About 4-amino-1-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]pyrrole-2-carboxamide

4-amino-1-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]pyrrole-2-carboxamide (PubChem CID 61102969) has the molecular formula C15H14N4O2 and a molecular weight of 282.30 g/mol. Its IUPAC name is 4-amino-1-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]pyrrole-2-carboxamide.

Molecular Properties

Compound Name4-amino-1-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]pyrrole-2-carboxamide
PubChem CID61102969
Molecular FormulaC15H14N4O2
Molecular Weight282.30 g/mol
Exact Mass282.11
IUPAC Name4-amino-1-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]pyrrole-2-carboxamide
SMILESCn1cc(N)cc1C(=O)Nc1cccc(-c2cnco2)c1
InChIInChI=1S/C15H14N4O2/c1-19-8-11(16)6-13(19)15(20)18-12-4-2-3-10(5-12)14-7-17-9-21-14/h2-9H,16H2,1H3,(H,18,20)
InChIKeyFEANWBDDBPMHRB-UHFFFAOYSA-N
XLogP2.51
TPSA86.08 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.30
LogP ≤ 52.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 4-amino-1-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]pyrrole-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-amino-1-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]pyrrole-2-carboxamide?
The IUPAC name of 4-amino-1-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]pyrrole-2-carboxamide (CID 61102969) is 4-amino-1-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]pyrrole-2-carboxamide.
What is the SMILES notation for 4-amino-1-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]pyrrole-2-carboxamide?
The canonical SMILES for 4-amino-1-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]pyrrole-2-carboxamide is Cn1cc(N)cc1C(=O)Nc1cccc(-c2cnco2)c1.
What is the InChIKey of 4-amino-1-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]pyrrole-2-carboxamide?
The InChIKey is FEANWBDDBPMHRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O2/c1-19-8-11(16)6-13(19)15(20)18-12-4-2-3-10(5-12)14-7-17-9-21-14/h2-9H,16H2,1H3,(H,18,20).
What are the key properties of 4-amino-1-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]pyrrole-2-carboxamide?
4-amino-1-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]pyrrole-2-carboxamide has a molecular weight of 282.30 g/mol, XLogP of 2.51, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-1-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]pyrrole-2-carboxamide is sourced from PubChem (CID 61102969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).