1-(8-tricyclo[5.2.1.02,6]decanylamino)-2,3-dihydro-1H-inden-4-ol

C19H25NO — CID 43726758

IUPAC1-(8-tricyclo[5.2.1.02,6]decanylamino)-2,3-dihydro-1H-inden-4-ol
SMILESOc1cccc2c1CCC2NC1CC2CC1C1CCCC21
InChIInChI=1S/C19H25NO/c21-19-6-2-5-14-15(19)7-8-17(14)20-18-10-11-9-16(18)13-4-1-3-12(11)13/h2,5-6,11-13,16-18,20-21H,1,3-4,7-10H2
InChIKeyJGNICSCRTRYSLS-UHFFFAOYSA-N
MW283.41 g/mol
LogP3.79
Rot. Bonds2

About 1-(8-tricyclo[5.2.1.02,6]decanylamino)-2,3-dihydro-1H-inden-4-ol

1-(8-tricyclo[5.2.1.02,6]decanylamino)-2,3-dihydro-1H-inden-4-ol (PubChem CID 43726758) has the molecular formula C19H25NO and a molecular weight of 283.41 g/mol. Its IUPAC name is 1-(8-tricyclo[5.2.1.02,6]decanylamino)-2,3-dihydro-1H-inden-4-ol.

Molecular Properties

Compound Name1-(8-tricyclo[5.2.1.02,6]decanylamino)-2,3-dihydro-1H-inden-4-ol
PubChem CID43726758
Molecular FormulaC19H25NO
Molecular Weight283.41 g/mol
Exact Mass283.19
IUPAC Name1-(8-tricyclo[5.2.1.02,6]decanylamino)-2,3-dihydro-1H-inden-4-ol
SMILESOc1cccc2c1CCC2NC1CC2CC1C1CCCC21
InChIInChI=1S/C19H25NO/c21-19-6-2-5-14-15(19)7-8-17(14)20-18-10-11-9-16(18)13-4-1-3-12(11)13/h2,5-6,11-13,16-18,20-21H,1,3-4,7-10H2
InChIKeyJGNICSCRTRYSLS-UHFFFAOYSA-N
XLogP3.79
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.41
LogP ≤ 53.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(8-tricyclo[5.2.1.02,6]decanylamino)-2,3-dihydro-1H-inden-4-ol?
The IUPAC name of 1-(8-tricyclo[5.2.1.02,6]decanylamino)-2,3-dihydro-1H-inden-4-ol (CID 43726758) is 1-(8-tricyclo[5.2.1.02,6]decanylamino)-2,3-dihydro-1H-inden-4-ol.
What is the SMILES notation for 1-(8-tricyclo[5.2.1.02,6]decanylamino)-2,3-dihydro-1H-inden-4-ol?
The canonical SMILES for 1-(8-tricyclo[5.2.1.02,6]decanylamino)-2,3-dihydro-1H-inden-4-ol is Oc1cccc2c1CCC2NC1CC2CC1C1CCCC21.
What is the InChIKey of 1-(8-tricyclo[5.2.1.02,6]decanylamino)-2,3-dihydro-1H-inden-4-ol?
The InChIKey is JGNICSCRTRYSLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO/c21-19-6-2-5-14-15(19)7-8-17(14)20-18-10-11-9-16(18)13-4-1-3-12(11)13/h2,5-6,11-13,16-18,20-21H,1,3-4,7-10H2.
What are the key properties of 1-(8-tricyclo[5.2.1.02,6]decanylamino)-2,3-dihydro-1H-inden-4-ol?
1-(8-tricyclo[5.2.1.02,6]decanylamino)-2,3-dihydro-1H-inden-4-ol has a molecular weight of 283.41 g/mol, XLogP of 3.79, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(8-tricyclo[5.2.1.02,6]decanylamino)-2,3-dihydro-1H-inden-4-ol is sourced from PubChem (CID 43726758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).