ethyl N-[3,4-dihydroxy-5-(3-methoxyphenyl)furan-2-yl]carbamate

C14H15NO6 — CID 90081283

IUPACethyl N-[3,4-dihydroxy-5-(3-methoxyphenyl)furan-2-yl]carbamate
SMILESCCOC(=O)Nc1oc(-c2cccc(OC)c2)c(O)c1O
InChIInChI=1S/C14H15NO6/c1-3-20-14(18)15-13-11(17)10(16)12(21-13)8-5-4-6-9(7-8)19-2/h4-7,16-17H,3H2,1-2H3,(H,15,18)
InChIKeyZVKRFEDUKZLUFN-UHFFFAOYSA-N
MW293.28 g/mol
LogP2.93
Rot. Bonds4

About ethyl N-[3,4-dihydroxy-5-(3-methoxyphenyl)furan-2-yl]carbamate

ethyl N-[3,4-dihydroxy-5-(3-methoxyphenyl)furan-2-yl]carbamate (PubChem CID 90081283) has the molecular formula C14H15NO6 and a molecular weight of 293.28 g/mol. Its IUPAC name is ethyl N-[3,4-dihydroxy-5-(3-methoxyphenyl)furan-2-yl]carbamate.

Molecular Properties

Compound Nameethyl N-[3,4-dihydroxy-5-(3-methoxyphenyl)furan-2-yl]carbamate
PubChem CID90081283
Molecular FormulaC14H15NO6
Molecular Weight293.28 g/mol
Exact Mass293.09
IUPAC Nameethyl N-[3,4-dihydroxy-5-(3-methoxyphenyl)furan-2-yl]carbamate
SMILESCCOC(=O)Nc1oc(-c2cccc(OC)c2)c(O)c1O
InChIInChI=1S/C14H15NO6/c1-3-20-14(18)15-13-11(17)10(16)12(21-13)8-5-4-6-9(7-8)19-2/h4-7,16-17H,3H2,1-2H3,(H,15,18)
InChIKeyZVKRFEDUKZLUFN-UHFFFAOYSA-N
XLogP2.93
TPSA101.16 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.28
LogP ≤ 52.93
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze ethyl N-[3,4-dihydroxy-5-(3-methoxyphenyl)furan-2-yl]carbamate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

ethyl N-[5-(3,5-dimethoxyphenyl)-3,4-dihydroxyfuran-2-yl]carbamate
CID 90081736
[2-(ethoxycarbonylamino)-4-hydroxy-5-(3-methoxyphenyl)furan-3-yl] acetate
CID 90082253
ethyl N-[5-(3,4-difluorophenyl)-3,4-dihydroxyfuran-2-yl]carbamate
CID 90081156
ethyl N-[5-(2-fluorophenyl)-3,4-dihydroxyfuran-2-yl]carbamate
CID 90081842
N-[3,4-dihydroxy-5-(4-methoxyphenyl)furan-2-yl]acetamide
CID 90081194
4-bromo-N-[4-hydroxy-5-(3-methoxyphenyl)-3-trimethylsilyloxyfuran-2-yl]butanamide
CID 90081289
ethyl 2-[[2-(3-methoxyphenyl)-1,3-oxazol-5-yl]amino]-2-oxoacetate
CID 13172203
ethyl 5-(3-methoxyphenyl)-1,3-oxazole-4-carboxylate
CID 46942091
ethyl N-[(3-methoxyphenyl)carbamoyl]carbamate
CID 13221153
[2-(ethoxycarbonylamino)-5-(furan-2-yl)-4-hydroxyfuran-3-yl] acetate
CID 90081391
ethyl 2-[[5-(3-methoxyphenyl)-1,3,4-oxadiazol-2-yl]methylamino]-2-oxoacetate
CID 110320032
ethyl N-(2,4-dimethoxyphenyl)carbamate
CID 2741048

Frequently Asked Questions

What is the IUPAC name of ethyl N-[3,4-dihydroxy-5-(3-methoxyphenyl)furan-2-yl]carbamate?
The IUPAC name of ethyl N-[3,4-dihydroxy-5-(3-methoxyphenyl)furan-2-yl]carbamate (CID 90081283) is ethyl N-[3,4-dihydroxy-5-(3-methoxyphenyl)furan-2-yl]carbamate.
What is the SMILES notation for ethyl N-[3,4-dihydroxy-5-(3-methoxyphenyl)furan-2-yl]carbamate?
The canonical SMILES for ethyl N-[3,4-dihydroxy-5-(3-methoxyphenyl)furan-2-yl]carbamate is CCOC(=O)Nc1oc(-c2cccc(OC)c2)c(O)c1O.
What is the InChIKey of ethyl N-[3,4-dihydroxy-5-(3-methoxyphenyl)furan-2-yl]carbamate?
The InChIKey is ZVKRFEDUKZLUFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO6/c1-3-20-14(18)15-13-11(17)10(16)12(21-13)8-5-4-6-9(7-8)19-2/h4-7,16-17H,3H2,1-2H3,(H,15,18).
What are the key properties of ethyl N-[3,4-dihydroxy-5-(3-methoxyphenyl)furan-2-yl]carbamate?
ethyl N-[3,4-dihydroxy-5-(3-methoxyphenyl)furan-2-yl]carbamate has a molecular weight of 293.28 g/mol, XLogP of 2.93, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl N-[3,4-dihydroxy-5-(3-methoxyphenyl)furan-2-yl]carbamate is sourced from PubChem (CID 90081283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).