2-(2,3,4,5-tetrahydro-1H-inden-5-yloxy)ethanamine

C11H17NO — CID 141057839

IUPAC2-(2,3,4,5-tetrahydro-1H-inden-5-yloxy)ethanamine
SMILESNCCOC1C=CC2=C(CCC2)C1
InChIInChI=1S/C11H17NO/c12-6-7-13-11-5-4-9-2-1-3-10(9)8-11/h4-5,11H,1-3,6-8,12H2
InChIKeyFGYHAJWDOMFNHN-UHFFFAOYSA-N
MW179.26 g/mol
LogP1.77
Rot. Bonds3

About 2-(2,3,4,5-tetrahydro-1H-inden-5-yloxy)ethanamine

2-(2,3,4,5-tetrahydro-1H-inden-5-yloxy)ethanamine (PubChem CID 141057839) has the molecular formula C11H17NO and a molecular weight of 179.26 g/mol. Its IUPAC name is 2-(2,3,4,5-tetrahydro-1H-inden-5-yloxy)ethanamine.

Molecular Properties

Compound Name2-(2,3,4,5-tetrahydro-1H-inden-5-yloxy)ethanamine
PubChem CID141057839
Molecular FormulaC11H17NO
Molecular Weight179.26 g/mol
Exact Mass179.13
IUPAC Name2-(2,3,4,5-tetrahydro-1H-inden-5-yloxy)ethanamine
SMILESNCCOC1C=CC2=C(CCC2)C1
InChIInChI=1S/C11H17NO/c12-6-7-13-11-5-4-9-2-1-3-10(9)8-11/h4-5,11H,1-3,6-8,12H2
InChIKeyFGYHAJWDOMFNHN-UHFFFAOYSA-N
XLogP1.77
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.26
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3a,6-dihydro-2H-cyclopenta[e][1]benzofuran-8-yl)ethanamine;hydrochloride
CID 22004817
2-(3a,6-dihydro-2H-cyclopenta[e][1]benzofuran-8-yl)ethanamine
CID 22004818
2-(2,3,4,5-Tetrahydro-1-benzofuran-2-yl)ethanamine
CID 57288704
2,3-Dimethyl-4-(oxolan-2-yl)cyclohexa-2,4-dien-1-amine
CID 89073822
1,3,4,6-Tetrahydrocyclopenta[c]pyran-1-ylmethanamine
CID 89532757
2-Cyclooct-2-en-1-yloxyethanamine
CID 123280115
[(2S,6R)-6-[(3Z,5E)-5-chlorohepta-1,3,5-trien-2-yl]oxan-2-yl]methanamine
CID 129191872
2-[(2Z)-cyclooct-2-en-1-yl]oxyethanamine
CID 133623349
[(2R,6S)-6-[(2E)-5-methylhexa-2,4-dien-2-yl]oxan-2-yl]methanamine
CID 134408152
1,3,4,5,6,7,8,9-Octahydroindeno[2,1-c]pyran-1-ylmethanamine
CID 142603364
2-[2-(3-Aminopropyl)cyclohexa-2,4-dien-1-yl]oxypropan-1-amine
CID 142994221
2-[(2Z)-3-methylcyclooct-2-en-1-yl]oxyethanamine
CID 156530402

Frequently Asked Questions

What is the IUPAC name of 2-(2,3,4,5-tetrahydro-1H-inden-5-yloxy)ethanamine?
The IUPAC name of 2-(2,3,4,5-tetrahydro-1H-inden-5-yloxy)ethanamine (CID 141057839) is 2-(2,3,4,5-tetrahydro-1H-inden-5-yloxy)ethanamine.
What is the SMILES notation for 2-(2,3,4,5-tetrahydro-1H-inden-5-yloxy)ethanamine?
The canonical SMILES for 2-(2,3,4,5-tetrahydro-1H-inden-5-yloxy)ethanamine is NCCOC1C=CC2=C(CCC2)C1.
What is the InChIKey of 2-(2,3,4,5-tetrahydro-1H-inden-5-yloxy)ethanamine?
The InChIKey is FGYHAJWDOMFNHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO/c12-6-7-13-11-5-4-9-2-1-3-10(9)8-11/h4-5,11H,1-3,6-8,12H2.
What are the key properties of 2-(2,3,4,5-tetrahydro-1H-inden-5-yloxy)ethanamine?
2-(2,3,4,5-tetrahydro-1H-inden-5-yloxy)ethanamine has a molecular weight of 179.26 g/mol, XLogP of 1.77, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3,4,5-tetrahydro-1H-inden-5-yloxy)ethanamine is sourced from PubChem (CID 141057839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).