1-(ethylamino)-2,3,4,5-tetrahydro-1H-inden-2-ol

C11H17NO — CID 123990062

IUPAC1-(ethylamino)-2,3,4,5-tetrahydro-1H-inden-2-ol
SMILESCCNC1C2=C(CCC=C2)CC1O
InChIInChI=1S/C11H17NO/c1-2-12-11-9-6-4-3-5-8(9)7-10(11)13/h4,6,10-13H,2-3,5,7H2,1H3
InChIKeySDGDFWVKGKHPPN-UHFFFAOYSA-N
MW179.26 g/mol
LogP1.38
Rot. Bonds2

About 1-(ethylamino)-2,3,4,5-tetrahydro-1H-inden-2-ol

1-(ethylamino)-2,3,4,5-tetrahydro-1H-inden-2-ol (PubChem CID 123990062) has the molecular formula C11H17NO and a molecular weight of 179.26 g/mol. Its IUPAC name is 1-(ethylamino)-2,3,4,5-tetrahydro-1H-inden-2-ol.

Molecular Properties

Compound Name1-(ethylamino)-2,3,4,5-tetrahydro-1H-inden-2-ol
PubChem CID123990062
Molecular FormulaC11H17NO
Molecular Weight179.26 g/mol
Exact Mass179.13
IUPAC Name1-(ethylamino)-2,3,4,5-tetrahydro-1H-inden-2-ol
SMILESCCNC1C2=C(CCC=C2)CC1O
InChIInChI=1S/C11H17NO/c1-2-12-11-9-6-4-3-5-8(9)7-10(11)13/h4,6,10-13H,2-3,5,7H2,1H3
InChIKeySDGDFWVKGKHPPN-UHFFFAOYSA-N
XLogP1.38
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.26
LogP ≤ 51.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 25140000
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Frequently Asked Questions

What is the IUPAC name of 1-(ethylamino)-2,3,4,5-tetrahydro-1H-inden-2-ol?
The IUPAC name of 1-(ethylamino)-2,3,4,5-tetrahydro-1H-inden-2-ol (CID 123990062) is 1-(ethylamino)-2,3,4,5-tetrahydro-1H-inden-2-ol.
What is the SMILES notation for 1-(ethylamino)-2,3,4,5-tetrahydro-1H-inden-2-ol?
The canonical SMILES for 1-(ethylamino)-2,3,4,5-tetrahydro-1H-inden-2-ol is CCNC1C2=C(CCC=C2)CC1O.
What is the InChIKey of 1-(ethylamino)-2,3,4,5-tetrahydro-1H-inden-2-ol?
The InChIKey is SDGDFWVKGKHPPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO/c1-2-12-11-9-6-4-3-5-8(9)7-10(11)13/h4,6,10-13H,2-3,5,7H2,1H3.
What are the key properties of 1-(ethylamino)-2,3,4,5-tetrahydro-1H-inden-2-ol?
1-(ethylamino)-2,3,4,5-tetrahydro-1H-inden-2-ol has a molecular weight of 179.26 g/mol, XLogP of 1.38, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(ethylamino)-2,3,4,5-tetrahydro-1H-inden-2-ol is sourced from PubChem (CID 123990062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).