3-(2-aminoethyl)-2,3-dihydro-1H-inden-5-ol

C11H15NO — CID 83827747

IUPAC3-(2-aminoethyl)-2,3-dihydro-1H-inden-5-ol
SMILESNCCC1CCc2ccc(O)cc21
InChIInChI=1S/C11H15NO/c12-6-5-9-2-1-8-3-4-10(13)7-11(8)9/h3-4,7,9,13H,1-2,5-6,12H2
InChIKeyXFOKYTAGEBCHOL-UHFFFAOYSA-N
MW177.25 g/mol
LogP1.77
Rot. Bonds2

About 3-(2-aminoethyl)-2,3-dihydro-1H-inden-5-ol

3-(2-aminoethyl)-2,3-dihydro-1H-inden-5-ol (PubChem CID 83827747) has the molecular formula C11H15NO and a molecular weight of 177.25 g/mol. Its IUPAC name is 3-(2-aminoethyl)-2,3-dihydro-1H-inden-5-ol.

Molecular Properties

Compound Name3-(2-aminoethyl)-2,3-dihydro-1H-inden-5-ol
PubChem CID83827747
Molecular FormulaC11H15NO
Molecular Weight177.25 g/mol
Exact Mass177.12
IUPAC Name3-(2-aminoethyl)-2,3-dihydro-1H-inden-5-ol
SMILESNCCC1CCc2ccc(O)cc21
InChIInChI=1S/C11H15NO/c12-6-5-9-2-1-8-3-4-10(13)7-11(8)9/h3-4,7,9,13H,1-2,5-6,12H2
InChIKeyXFOKYTAGEBCHOL-UHFFFAOYSA-N
XLogP1.77
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 51.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-(2-aminoethyl)-N,N-dimethyl-2,3-dihydro-1H-inden-5-amine
CID 105456837
2-[(1R)-6-methoxy-2,3-dihydro-1H-inden-1-yl]ethanamine
CID 10900371
2-(6-propan-2-yl-2,3-dihydro-1H-inden-1-yl)ethanamine
CID 82076845
5-(2-aminoethyl)-2,3,4,5-tetrahydro-1-benzothiepin-7-ol
CID 82391933
2-(7-hydroxy-1,2,3,4-tetrahydronaphthalen-1-yl)acetic acid
CID 68629787
[[8-(2-aminoethyl)-5,6,7,8-tetrahydronaphthalen-2-yl]amino]methanol
CID 59957000
2-(7-ethyl-1,2,3,4-tetrahydronaphthalen-1-yl)ethanamine
CID 15816636
3-[(propan-2-ylamino)methyl]-2,3-dihydro-1H-inden-5-ol
CID 105458052
2-[(1R)-7-ethyl-1,2,3,4-tetrahydronaphthalen-1-yl]ethanamine
CID 67627169
N-[2-(7-hydroxy-1,2,3,4-tetrahydronaphthalen-1-yl)ethyl]cyclopropanecarboxamide
CID 18360715
N'-[(E)-3-(6-hydroxy-2,3-dihydro-1H-inden-1-yl)prop-1-enyl]methanimidamide
CID 142903262
2-[7-(4-methylphenyl)-1,2,3,4-tetrahydronaphthalen-1-yl]ethanamine
CID 82542874

Frequently Asked Questions

What is the IUPAC name of 3-(2-aminoethyl)-2,3-dihydro-1H-inden-5-ol?
The IUPAC name of 3-(2-aminoethyl)-2,3-dihydro-1H-inden-5-ol (CID 83827747) is 3-(2-aminoethyl)-2,3-dihydro-1H-inden-5-ol.
What is the SMILES notation for 3-(2-aminoethyl)-2,3-dihydro-1H-inden-5-ol?
The canonical SMILES for 3-(2-aminoethyl)-2,3-dihydro-1H-inden-5-ol is NCCC1CCc2ccc(O)cc21.
What is the InChIKey of 3-(2-aminoethyl)-2,3-dihydro-1H-inden-5-ol?
The InChIKey is XFOKYTAGEBCHOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO/c12-6-5-9-2-1-8-3-4-10(13)7-11(8)9/h3-4,7,9,13H,1-2,5-6,12H2.
What are the key properties of 3-(2-aminoethyl)-2,3-dihydro-1H-inden-5-ol?
3-(2-aminoethyl)-2,3-dihydro-1H-inden-5-ol has a molecular weight of 177.25 g/mol, XLogP of 1.77, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-aminoethyl)-2,3-dihydro-1H-inden-5-ol is sourced from PubChem (CID 83827747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).