propan-2-yl 3-fluoro-4H-furo[3,2-b]pyrrole-5-carboxylate

C10H10FNO3 — CID 70885158

IUPACpropan-2-yl 3-fluoro-4H-furo[3,2-b]pyrrole-5-carboxylate
SMILESCC(C)OC(=O)c1cc2occ(F)c2[nH]1
InChIInChI=1S/C10H10FNO3/c1-5(2)15-10(13)7-3-8-9(12-7)6(11)4-14-8/h3-5,12H,1-2H3
InChIKeyMNDRZQVZKZOBFT-UHFFFAOYSA-N
MW211.19 g/mol
LogP2.47
Rot. Bonds2

About propan-2-yl 3-fluoro-4H-furo[3,2-b]pyrrole-5-carboxylate

propan-2-yl 3-fluoro-4H-furo[3,2-b]pyrrole-5-carboxylate (PubChem CID 70885158) has the molecular formula C10H10FNO3 and a molecular weight of 211.19 g/mol. Its IUPAC name is propan-2-yl 3-fluoro-4H-furo[3,2-b]pyrrole-5-carboxylate.

Molecular Properties

Compound Namepropan-2-yl 3-fluoro-4H-furo[3,2-b]pyrrole-5-carboxylate
PubChem CID70885158
Molecular FormulaC10H10FNO3
Molecular Weight211.19 g/mol
Exact Mass211.06
IUPAC Namepropan-2-yl 3-fluoro-4H-furo[3,2-b]pyrrole-5-carboxylate
SMILESCC(C)OC(=O)c1cc2occ(F)c2[nH]1
InChIInChI=1S/C10H10FNO3/c1-5(2)15-10(13)7-3-8-9(12-7)6(11)4-14-8/h3-5,12H,1-2H3
InChIKeyMNDRZQVZKZOBFT-UHFFFAOYSA-N
XLogP2.47
TPSA55.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.19
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

ethane;propan-2-yl 2-fluoro-4H-furo[3,2-b]pyrrole-5-carboxylate
CID 143939709
propan-2-yl 4-fluoro-5-iodo-1H-pyrrole-2-carboxylate
CID 133061244
propan-2-yl 4H-furo[3,2-b]pyrrole-5-carboxylate
CID 50923959
propan-2-yl 4,5-dichloro-1H-pyrrole-2-carboxylate
CID 112725038
CID 50923065
CID 50923065
ethyl 3-bromo-4H-furo[3,2-b]pyrrole-5-carboxylate
CID 59648581
propan-2-yl 2-fluoro-1H-imidazole-5-carboxylate
CID 139436709
3-methoxycarbonyl-4H-furo[3,2-b]pyrrole-5-carboxylic acid
CID 138007640
3-bromo-4H-furo[3,2-b]pyrrole-5-carboxylic acid;ethyl 3-bromo-4H-furo[3,2-b]pyrrole-5-carboxylate
CID 161174395
propan-2-yl 5-iodofuran-3-carboxylate
CID 133061928
lithium;ethyl 3-(trifluoromethyl)-4H-furo[3,2-b]pyrrole-5-carboxylate;3-(trifluoromethyl)-4H-furo[3,2-b]pyrrole-5-carboxylic acid;hydroxide;hydrate
CID 159835780
propan-2-yl 6-[(E)-N-tert-butylsulfinyl-C-methylcarbonimidoyl]-5-fluoro-1H-pyrrolo[2,3-b]pyridine-2-carboxylate
CID 166561214

Frequently Asked Questions

What is the IUPAC name of propan-2-yl 3-fluoro-4H-furo[3,2-b]pyrrole-5-carboxylate?
The IUPAC name of propan-2-yl 3-fluoro-4H-furo[3,2-b]pyrrole-5-carboxylate (CID 70885158) is propan-2-yl 3-fluoro-4H-furo[3,2-b]pyrrole-5-carboxylate.
What is the SMILES notation for propan-2-yl 3-fluoro-4H-furo[3,2-b]pyrrole-5-carboxylate?
The canonical SMILES for propan-2-yl 3-fluoro-4H-furo[3,2-b]pyrrole-5-carboxylate is CC(C)OC(=O)c1cc2occ(F)c2[nH]1.
What is the InChIKey of propan-2-yl 3-fluoro-4H-furo[3,2-b]pyrrole-5-carboxylate?
The InChIKey is MNDRZQVZKZOBFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10FNO3/c1-5(2)15-10(13)7-3-8-9(12-7)6(11)4-14-8/h3-5,12H,1-2H3.
What are the key properties of propan-2-yl 3-fluoro-4H-furo[3,2-b]pyrrole-5-carboxylate?
propan-2-yl 3-fluoro-4H-furo[3,2-b]pyrrole-5-carboxylate has a molecular weight of 211.19 g/mol, XLogP of 2.47, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for propan-2-yl 3-fluoro-4H-furo[3,2-b]pyrrole-5-carboxylate is sourced from PubChem (CID 70885158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).