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

C12H15NO2 — CID 174986935

IUPAC2-(2,3-dihydro-1H-inden-5-yl)ethyl carbamate
SMILESNC(=O)OCCc1ccc2c(c1)CCC2
InChIInChI=1S/C12H15NO2/c13-12(14)15-7-6-9-4-5-10-2-1-3-11(10)8-9/h4-5,8H,1-3,6-7H2,(H2,13,14)
InChIKeyFFWMSTRDEJXZAB-UHFFFAOYSA-N
MW205.26 g/mol
LogP1.81
Rot. Bonds3

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

2-(2,3-dihydro-1H-inden-5-yl)ethyl carbamate (PubChem CID 174986935) has the molecular formula C12H15NO2 and a molecular weight of 205.26 g/mol. Its IUPAC name is 2-(2,3-dihydro-1H-inden-5-yl)ethyl carbamate.

Molecular Properties

Compound Name2-(2,3-dihydro-1H-inden-5-yl)ethyl carbamate
PubChem CID174986935
Molecular FormulaC12H15NO2
Molecular Weight205.26 g/mol
Exact Mass205.11
IUPAC Name2-(2,3-dihydro-1H-inden-5-yl)ethyl carbamate
SMILESNC(=O)OCCc1ccc2c(c1)CCC2
InChIInChI=1S/C12H15NO2/c13-12(14)15-7-6-9-4-5-10-2-1-3-11(10)8-9/h4-5,8H,1-3,6-7H2,(H2,13,14)
InChIKeyFFWMSTRDEJXZAB-UHFFFAOYSA-N
XLogP1.81
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

O-[2-(2,3-dihydro-1H-inden-5-yl)ethyl]hydroxylamine
CID 83482053
3-(2,3-dihydro-1H-inden-5-yl)propanoic acid
CID 12646159
6-[2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]-1,2,3,4-tetrahydronaphthalene
CID 19914431
2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetamide
CID 25653
2-(2,3-dihydro-1H-inden-5-yl)ethanamine
CID 61070182
2,3-dihydro-1H-inden-5-ylmethyl carbonochloridate
CID 83820869
2-(2,3-dihydro-1H-inden-5-yl)ethanamine;hydrochloride
CID 135381745
2-[4-(hydroxymethyl)phenyl]ethyl carbamate
CID 67217532
5-(2,3-dihydro-1H-inden-5-yl)pentan-2-one
CID 64522132
ethyl N-[2-(2,3-dihydro-1H-inden-5-yl)ethyl]carbamate
CID 110787782
4-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)butyl acetate
CID 58389492
tert-butyl carbamate;5,6,7,8-tetrahydronaphthalen-2-ylmethanol
CID 143068293

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydro-1H-inden-5-yl)ethyl carbamate?
The IUPAC name of 2-(2,3-dihydro-1H-inden-5-yl)ethyl carbamate (CID 174986935) is 2-(2,3-dihydro-1H-inden-5-yl)ethyl carbamate.
What is the SMILES notation for 2-(2,3-dihydro-1H-inden-5-yl)ethyl carbamate?
The canonical SMILES for 2-(2,3-dihydro-1H-inden-5-yl)ethyl carbamate is NC(=O)OCCc1ccc2c(c1)CCC2.
What is the InChIKey of 2-(2,3-dihydro-1H-inden-5-yl)ethyl carbamate?
The InChIKey is FFWMSTRDEJXZAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO2/c13-12(14)15-7-6-9-4-5-10-2-1-3-11(10)8-9/h4-5,8H,1-3,6-7H2,(H2,13,14).
What are the key properties of 2-(2,3-dihydro-1H-inden-5-yl)ethyl carbamate?
2-(2,3-dihydro-1H-inden-5-yl)ethyl carbamate has a molecular weight of 205.26 g/mol, XLogP of 1.81, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydro-1H-inden-5-yl)ethyl carbamate is sourced from PubChem (CID 174986935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).