methyl 4-(1-morpholin-4-yl-1-oxobutan-2-yl)furo[3,2-b]pyrrole-5-carboxylate

C16H20N2O5 — CID 3241399

IUPACmethyl 4-(1-morpholin-4-yl-1-oxobutan-2-yl)furo[3,2-b]pyrrole-5-carboxylate
SMILESCCC(C(=O)N1CCOCC1)n1c(C(=O)OC)cc2occc21
InChIInChI=1S/C16H20N2O5/c1-3-11(15(19)17-5-8-22-9-6-17)18-12-4-7-23-14(12)10-13(18)16(20)21-2/h4,7,10-11H,3,5-6,8-9H2,1-2H3
InChIKeyWKDIZKCFXROPMQ-UHFFFAOYSA-N
MW320.35 g/mol
LogP1.83
Rot. Bonds4

About methyl 4-(1-morpholin-4-yl-1-oxobutan-2-yl)furo[3,2-b]pyrrole-5-carboxylate

methyl 4-(1-morpholin-4-yl-1-oxobutan-2-yl)furo[3,2-b]pyrrole-5-carboxylate (PubChem CID 3241399) has the molecular formula C16H20N2O5 and a molecular weight of 320.35 g/mol. Its IUPAC name is methyl 4-(1-morpholin-4-yl-1-oxobutan-2-yl)furo[3,2-b]pyrrole-5-carboxylate.

Molecular Properties

Compound Namemethyl 4-(1-morpholin-4-yl-1-oxobutan-2-yl)furo[3,2-b]pyrrole-5-carboxylate
PubChem CID3241399
Molecular FormulaC16H20N2O5
Molecular Weight320.35 g/mol
Exact Mass320.14
IUPAC Namemethyl 4-(1-morpholin-4-yl-1-oxobutan-2-yl)furo[3,2-b]pyrrole-5-carboxylate
SMILESCCC(C(=O)N1CCOCC1)n1c(C(=O)OC)cc2occc21
InChIInChI=1S/C16H20N2O5/c1-3-11(15(19)17-5-8-22-9-6-17)18-12-4-7-23-14(12)10-13(18)16(20)21-2/h4,7,10-11H,3,5-6,8-9H2,1-2H3
InChIKeyWKDIZKCFXROPMQ-UHFFFAOYSA-N
XLogP1.83
TPSA73.91 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.35
LogP ≤ 51.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze methyl 4-(1-morpholin-4-yl-1-oxobutan-2-yl)furo[3,2-b]pyrrole-5-carboxylate with MolForge

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Related Compounds

methyl 4H-furo[3,2-b]pyrrole-5-carboxylate
CID 5082263
Methyl trans-4-(4-(2-(ethyl(m-tolyl)amino)-2-oxoethyl)-4H-furo[3,2-b]pyrrole-5carboxamido)cyclohexane-1-carboxylate (31)
CID 124155030
methyl 4-{[2-(2-fluorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-4H-furo[3,2-b]pyrrole-5-carboxylate
CID 16011014
Methyl 4-{[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-YL]methyl}-4H-furo[3,2-B]pyrrole-5-carboxylate
CID 16011163
4-Cyclohexyloxycarbonylmethyl-2-methyl-4H-furo[3,2-b]pyrrole-5-carboxylic acid ethyl ester
CID 652843
4-[(4-Methyl-cyclohexylcarbamoyl)-methyl]-4H-furo[3,2-b]pyrrole-5-carboxylic acid ethyl ester
CID 656205
4-(4-Fluoro-benzyl)-4H-furo[3,2-b]pyrrole-5-carboxylic acid ethyl ester
CID 1438681
2,4-Dimethyl-5-furo[3,2-b]pyrrolecarboxylic acid [3-methyl-1-oxo-1-(2-oxolanylmethylamino)butan-2-yl] ester
CID 3228603
2-(5-ethyl-8-oxofuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)-N-[2-(4-methylpiperazin-1-yl)ethyl]acetamide
CID 3235699
4-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]-2-methyl-5-furo[3,2-b]pyrrolecarboxylic acid methyl ester
CID 3236476
1-[2-(2-Methoxyanilino)-2-oxoethyl]-2-benzofuro[3,2-b]pyrrolecarboxylic acid methyl ester
CID 3238241
Methyl 4-[2-(3,5-dimethylanilino)-2-oxoethyl]-2-methyl-4H-furo[3,2-B]pyrrole-5-carboxylate
CID 3239201

Frequently Asked Questions

What is the IUPAC name of methyl 4-(1-morpholin-4-yl-1-oxobutan-2-yl)furo[3,2-b]pyrrole-5-carboxylate?
The IUPAC name of methyl 4-(1-morpholin-4-yl-1-oxobutan-2-yl)furo[3,2-b]pyrrole-5-carboxylate (CID 3241399) is methyl 4-(1-morpholin-4-yl-1-oxobutan-2-yl)furo[3,2-b]pyrrole-5-carboxylate.
What is the SMILES notation for methyl 4-(1-morpholin-4-yl-1-oxobutan-2-yl)furo[3,2-b]pyrrole-5-carboxylate?
The canonical SMILES for methyl 4-(1-morpholin-4-yl-1-oxobutan-2-yl)furo[3,2-b]pyrrole-5-carboxylate is CCC(C(=O)N1CCOCC1)n1c(C(=O)OC)cc2occc21.
What is the InChIKey of methyl 4-(1-morpholin-4-yl-1-oxobutan-2-yl)furo[3,2-b]pyrrole-5-carboxylate?
The InChIKey is WKDIZKCFXROPMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O5/c1-3-11(15(19)17-5-8-22-9-6-17)18-12-4-7-23-14(12)10-13(18)16(20)21-2/h4,7,10-11H,3,5-6,8-9H2,1-2H3.
What are the key properties of methyl 4-(1-morpholin-4-yl-1-oxobutan-2-yl)furo[3,2-b]pyrrole-5-carboxylate?
methyl 4-(1-morpholin-4-yl-1-oxobutan-2-yl)furo[3,2-b]pyrrole-5-carboxylate has a molecular weight of 320.35 g/mol, XLogP of 1.83, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 4-(1-morpholin-4-yl-1-oxobutan-2-yl)furo[3,2-b]pyrrole-5-carboxylate is sourced from PubChem (CID 3241399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).