Methyl 1-methyl-4-(1-methyl-4-nitropyrrole-2-carboxamido)pyrrole-2-carboxylate

HCID 592893

Basic information

Standard SMILES
COC(=O)c1cc(NC(=O)c2cc([N+](=O)[O-])cn2C)cn1C
InChIKey
CXOUMWIFPBNLCI-UHFFFAOYSA-N
Molecular formula
C13H14N4O5
Average molar mass
306.27 g/mol
Monoisotopic mass
306.09641956

Names & identifiers

Preferred name
Methyl 1-methyl-4-(1-methyl-4-nitropyrrole-2-carboxamido)pyrrole-2-carboxylate
IUPAC
methyl 1-methyl-4-[(1-methyl-4-nitropyrrole-2-carbonyl)amino]pyrrole-2-carboxylate

Names & synonyms

69910-20-9CHEMBL276453SCHEMBL2393205Methyl 1-methyl-4-(1-methyl-4-nitropyrrole-2-carboxamido)pyrrole-2-carboxylateDA-41656Methyl(1-methyl-4-(1-methyl-4-nitro-2-pyrrolamido)-2-pyrrolecarboxylate)Methyl 1-methyl-4-(1-methyl-4-nitro-1H-pyrrole-2-carboxamido)-1H-pyrrole-2-carboxylateMethyl 1-methyl-4-([(1-methyl-4-nitro-1H-pyrrol-2-yl)carbonyl]amino)-1H-pyrrole-2-carboxylate #

Database identifiers

PubChem CID
592893
ChEMBL
CHEMBL276453
Nikkaji
J1.361.855K

Properties

Computed structural properties

XLogP
0.6
Topological polar surface area
111 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
4
Heavy atoms
22

Related reactions

20 records

Compound notes

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