2-(1-benzofuran-6-yl)ethyl carbamate

C11H11NO3 — CID 151771491

IUPAC2-(1-benzofuran-6-yl)ethyl carbamate
SMILESNC(=O)OCCc1ccc2ccoc2c1
InChIInChI=1S/C11H11NO3/c12-11(13)15-5-3-8-1-2-9-4-6-14-10(9)7-8/h1-2,4,6-7H,3,5H2,(H2,12,13)
InChIKeyRSRGJMUZEYMXRK-UHFFFAOYSA-N
MW205.21 g/mol
LogP2.07
Rot. Bonds3

About 2-(1-benzofuran-6-yl)ethyl carbamate

2-(1-benzofuran-6-yl)ethyl carbamate (PubChem CID 151771491) has the molecular formula C11H11NO3 and a molecular weight of 205.21 g/mol. Its IUPAC name is 2-(1-benzofuran-6-yl)ethyl carbamate.

Molecular Properties

Compound Name2-(1-benzofuran-6-yl)ethyl carbamate
PubChem CID151771491
Molecular FormulaC11H11NO3
Molecular Weight205.21 g/mol
Exact Mass205.07
IUPAC Name2-(1-benzofuran-6-yl)ethyl carbamate
SMILESNC(=O)OCCc1ccc2ccoc2c1
InChIInChI=1S/C11H11NO3/c12-11(13)15-5-3-8-1-2-9-4-6-14-10(9)7-8/h1-2,4,6-7H,3,5H2,(H2,12,13)
InChIKeyRSRGJMUZEYMXRK-UHFFFAOYSA-N
XLogP2.07
TPSA65.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.21
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(1-benzofuran-6-yl)butan-1-ol
CID 173058838
2-[4-(hydroxymethyl)phenyl]ethyl carbamate
CID 67217532
2-(2,3-dihydro-1H-inden-5-yl)ethyl carbamate
CID 174986935
2-(4-chlorophenyl)ethyl carbamate
CID 90103604
6-(propan-2-yloxymethyl)-1-benzofuran
CID 171518537
diethyl 2-(1-benzofuran-6-yl)propanedioate
CID 166892758
(2S)-2-amino-4-(1-benzofuran-5-yl)butanoic acid
CID 168737389
1,7-bis(1-benzofuran-5-yl)heptane-3,5-dione
CID 58234278
4-(1-benzofuran-5-yl)butan-2-one
CID 70511812
[(2S)-1-(1-benzofuran-6-yl)propan-2-yl]-methylazanium
CID 168924314
3-(1-benzofuran-6-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid
CID 168924113
1-(1-benzofuran-6-yl)-N-methylpropan-2-amine;methanol
CID 168924242

Frequently Asked Questions

What is the IUPAC name of 2-(1-benzofuran-6-yl)ethyl carbamate?
The IUPAC name of 2-(1-benzofuran-6-yl)ethyl carbamate (CID 151771491) is 2-(1-benzofuran-6-yl)ethyl carbamate.
What is the SMILES notation for 2-(1-benzofuran-6-yl)ethyl carbamate?
The canonical SMILES for 2-(1-benzofuran-6-yl)ethyl carbamate is NC(=O)OCCc1ccc2ccoc2c1.
What is the InChIKey of 2-(1-benzofuran-6-yl)ethyl carbamate?
The InChIKey is RSRGJMUZEYMXRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO3/c12-11(13)15-5-3-8-1-2-9-4-6-14-10(9)7-8/h1-2,4,6-7H,3,5H2,(H2,12,13).
What are the key properties of 2-(1-benzofuran-6-yl)ethyl carbamate?
2-(1-benzofuran-6-yl)ethyl carbamate has a molecular weight of 205.21 g/mol, XLogP of 2.07, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-benzofuran-6-yl)ethyl carbamate is sourced from PubChem (CID 151771491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).