4-(3-(tert-butylamino)-2-methylquinoxalin-5-yl)-1H-pyrrole-2-carboxamide

HCID 89784259
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Basic information

Standard SMILES
Cc1nc2cccc(-c3c[nH]c(C(N)=O)c3)c2nc1NC(C)(C)C
InChIKey
BVFUBYDIYASTFC-UHFFFAOYSA-N
Molecular formula
C18H21N5O
Average molar mass
323.4 g/mol
Monoisotopic mass
323.17461031

Names & identifiers

Preferred name
4-(3-(tert-butylamino)-2-methylquinoxalin-5-yl)-1H-pyrrole-2-carboxamide
IUPAC
4-[3-(tert-butylamino)-2-methylquinoxalin-5-yl]-1H-pyrrole-2-carboxamide

Names & synonyms

CHEMBL3926062SCHEMBL15231547BVFUBYDIYASTFC-UHFFFAOYSA-NBDBM238739US9394297, 4204-(3-(tert-butylamino)-2-methylquinoxalin-5-yl)-1H-pyrrole-2-carboxamide

Database identifiers

PubChem CID
89784259
ChEMBL
CHEMBL3926062

Properties

Computed structural properties

XLogP
2.5
Topological polar surface area
96.7 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
24

Related reactions

2 records
New reaction record

Compound notes

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