ethyl N-[2-(2,3-dihydro-1H-inden-5-yl)ethyl]carbamate

C14H19NO2 — CID 110787782

IUPACethyl N-[2-(2,3-dihydro-1H-inden-5-yl)ethyl]carbamate
SMILESCCOC(=O)NCCc1ccc2c(c1)CCC2
InChIInChI=1S/C14H19NO2/c1-2-17-14(16)15-9-8-11-6-7-12-4-3-5-13(12)10-11/h6-7,10H,2-5,8-9H2,1H3,(H,15,16)
InChIKeyIQLSAUAMLRGQKA-UHFFFAOYSA-N
MW233.31 g/mol
LogP2.46
Rot. Bonds4

About ethyl N-[2-(2,3-dihydro-1H-inden-5-yl)ethyl]carbamate

ethyl N-[2-(2,3-dihydro-1H-inden-5-yl)ethyl]carbamate (PubChem CID 110787782) has the molecular formula C14H19NO2 and a molecular weight of 233.31 g/mol. Its IUPAC name is ethyl N-[2-(2,3-dihydro-1H-inden-5-yl)ethyl]carbamate.

Molecular Properties

Compound Nameethyl N-[2-(2,3-dihydro-1H-inden-5-yl)ethyl]carbamate
PubChem CID110787782
Molecular FormulaC14H19NO2
Molecular Weight233.31 g/mol
Exact Mass233.14
IUPAC Nameethyl N-[2-(2,3-dihydro-1H-inden-5-yl)ethyl]carbamate
SMILESCCOC(=O)NCCc1ccc2c(c1)CCC2
InChIInChI=1S/C14H19NO2/c1-2-17-14(16)15-9-8-11-6-7-12-4-3-5-13(12)10-11/h6-7,10H,2-5,8-9H2,1H3,(H,15,16)
InChIKeyIQLSAUAMLRGQKA-UHFFFAOYSA-N
XLogP2.46
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

ethyl N-[2-(3,4-dimethylphenyl)ethyl]carbamate
CID 110787279
N-[2-(2,3-dihydro-1H-inden-5-yl)ethyl]carbamoyl chloride
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ethyl N-[2-(4-methylphenyl)ethyl]carbamate
CID 22253656
2-amino-N-[2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]acetamide
CID 82495829
ethyl N-[2-(3,4-diethoxyphenyl)ethyl]carbamate
CID 60637680
N-[2-(2,3-dihydro-1H-inden-5-yl)ethyl]-2-(hydroxymethyl)butanamide
CID 115186693
3-amino-2-methyl-N-[2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]propanamide
CID 115153778
ethyl N-[2-(3-chloro-4-hydroxyphenyl)ethyl]carbamate
CID 100965495
ethyl N-[2-(4-fluorophenyl)ethyl]carbamate
CID 52904890
ethyl N-[2-(2-oxo-1,3-benzodioxol-5-yl)ethyl]carbamate
CID 71398963
N-[2-(2,3-dihydro-1H-inden-5-yl)ethyl]cyclobutanecarboxamide
CID 110787783
ethyl 4-[[2-(2,3-dihydro-1H-inden-5-yl)acetyl]amino]butanoate
CID 60645837

Frequently Asked Questions

What is the IUPAC name of ethyl N-[2-(2,3-dihydro-1H-inden-5-yl)ethyl]carbamate?
The IUPAC name of ethyl N-[2-(2,3-dihydro-1H-inden-5-yl)ethyl]carbamate (CID 110787782) is ethyl N-[2-(2,3-dihydro-1H-inden-5-yl)ethyl]carbamate.
What is the SMILES notation for ethyl N-[2-(2,3-dihydro-1H-inden-5-yl)ethyl]carbamate?
The canonical SMILES for ethyl N-[2-(2,3-dihydro-1H-inden-5-yl)ethyl]carbamate is CCOC(=O)NCCc1ccc2c(c1)CCC2.
What is the InChIKey of ethyl N-[2-(2,3-dihydro-1H-inden-5-yl)ethyl]carbamate?
The InChIKey is IQLSAUAMLRGQKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO2/c1-2-17-14(16)15-9-8-11-6-7-12-4-3-5-13(12)10-11/h6-7,10H,2-5,8-9H2,1H3,(H,15,16).
What are the key properties of ethyl N-[2-(2,3-dihydro-1H-inden-5-yl)ethyl]carbamate?
ethyl N-[2-(2,3-dihydro-1H-inden-5-yl)ethyl]carbamate has a molecular weight of 233.31 g/mol, XLogP of 2.46, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl N-[2-(2,3-dihydro-1H-inden-5-yl)ethyl]carbamate is sourced from PubChem (CID 110787782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).