methyl 5-(furan-2-carbonyl)indolizine-7-carboxylate

C15H11NO4 — CID 165114034

IUPACmethyl 5-(furan-2-carbonyl)indolizine-7-carboxylate
SMILESCOC(=O)c1cc(C(=O)c2ccco2)n2cccc2c1
InChIInChI=1S/C15H11NO4/c1-19-15(18)10-8-11-4-2-6-16(11)12(9-10)14(17)13-5-3-7-20-13/h2-9H,1H3
InChIKeyWUEKFYOSKVHWAA-UHFFFAOYSA-N
MW269.26 g/mol
LogP2.55
Rot. Bonds3

About methyl 5-(furan-2-carbonyl)indolizine-7-carboxylate

methyl 5-(furan-2-carbonyl)indolizine-7-carboxylate (PubChem CID 165114034) has the molecular formula C15H11NO4 and a molecular weight of 269.26 g/mol. Its IUPAC name is methyl 5-(furan-2-carbonyl)indolizine-7-carboxylate.

Molecular Properties

Compound Namemethyl 5-(furan-2-carbonyl)indolizine-7-carboxylate
PubChem CID165114034
Molecular FormulaC15H11NO4
Molecular Weight269.26 g/mol
Exact Mass269.07
IUPAC Namemethyl 5-(furan-2-carbonyl)indolizine-7-carboxylate
SMILESCOC(=O)c1cc(C(=O)c2ccco2)n2cccc2c1
InChIInChI=1S/C15H11NO4/c1-19-15(18)10-8-11-4-2-6-16(11)12(9-10)14(17)13-5-3-7-20-13/h2-9H,1H3
InChIKeyWUEKFYOSKVHWAA-UHFFFAOYSA-N
XLogP2.55
TPSA60.92 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.26
LogP ≤ 52.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

dimethyl 5-(furan-2-carbonylamino)benzene-1,3-dicarboxylate
CID 711226
3-(furan-2-carbonyl)indolizine-1-carbonitrile
CID 102429783
methyl 3-(furan-2-carbonylcarbamoylamino)benzoate
CID 2806361
furan-2-yl-(1-methylpyrrol-3-yl)methanone
CID 82280498
1,1'-biphenyl;methyl furan-2-carboxylate
CID 159970386
methyl 4-[3-(furan-2-carbonyl)-4-hydroxy-2-(3-methoxyphenyl)-5-oxo-2H-pyrrol-1-yl]benzoate
CID 108666566
methyl 5-(furan-2-carbonyloxy)-1-methylpyrazole-3-carboxylate
CID 2992589
methyl 3-amino-4-(furan-2-carbonylamino)benzoate
CID 110481051
methyl 4-[(E)-3-(furan-2-yl)-3-oxoprop-1-enyl]benzoate
CID 6264432
dimethyl 3-(furan-2-carbonyl)-1H-pyrazole-4,5-dicarboxylate
CID 5256064
furan-2-yl-[1-(2-iodoethyl)pyrrol-2-yl]methanone
CID 19914090
methyl 4-[[(E)-3-(furan-2-yl)-3-oxoprop-1-enyl]amino]benzoate
CID 2247349

Frequently Asked Questions

What is the IUPAC name of methyl 5-(furan-2-carbonyl)indolizine-7-carboxylate?
The IUPAC name of methyl 5-(furan-2-carbonyl)indolizine-7-carboxylate (CID 165114034) is methyl 5-(furan-2-carbonyl)indolizine-7-carboxylate.
What is the SMILES notation for methyl 5-(furan-2-carbonyl)indolizine-7-carboxylate?
The canonical SMILES for methyl 5-(furan-2-carbonyl)indolizine-7-carboxylate is COC(=O)c1cc(C(=O)c2ccco2)n2cccc2c1.
What is the InChIKey of methyl 5-(furan-2-carbonyl)indolizine-7-carboxylate?
The InChIKey is WUEKFYOSKVHWAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11NO4/c1-19-15(18)10-8-11-4-2-6-16(11)12(9-10)14(17)13-5-3-7-20-13/h2-9H,1H3.
What are the key properties of methyl 5-(furan-2-carbonyl)indolizine-7-carboxylate?
methyl 5-(furan-2-carbonyl)indolizine-7-carboxylate has a molecular weight of 269.26 g/mol, XLogP of 2.55, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 5-(furan-2-carbonyl)indolizine-7-carboxylate is sourced from PubChem (CID 165114034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).