1-(decylamino)-1H-inden-2-ol

C19H29NO — CID 151837661

IUPAC1-(decylamino)-1H-inden-2-ol
SMILESCCCCCCCCCCNC1C(O)=Cc2ccccc21
InChIInChI=1S/C19H29NO/c1-2-3-4-5-6-7-8-11-14-20-19-17-13-10-9-12-16(17)15-18(19)21/h9-10,12-13,15,19-21H,2-8,11,14H2,1H3
InChIKeySFZPTESTFLKRST-UHFFFAOYSA-N
MW287.45 g/mol
LogP5.37
Rot. Bonds10

About 1-(decylamino)-1H-inden-2-ol

1-(decylamino)-1H-inden-2-ol (PubChem CID 151837661) has the molecular formula C19H29NO and a molecular weight of 287.45 g/mol. Its IUPAC name is 1-(decylamino)-1H-inden-2-ol.

Molecular Properties

Compound Name1-(decylamino)-1H-inden-2-ol
PubChem CID151837661
Molecular FormulaC19H29NO
Molecular Weight287.45 g/mol
Exact Mass287.22
IUPAC Name1-(decylamino)-1H-inden-2-ol
SMILESCCCCCCCCCCNC1C(O)=Cc2ccccc21
InChIInChI=1S/C19H29NO/c1-2-3-4-5-6-7-8-11-14-20-19-17-13-10-9-12-16(17)15-18(19)21/h9-10,12-13,15,19-21H,2-8,11,14H2,1H3
InChIKeySFZPTESTFLKRST-UHFFFAOYSA-N
XLogP5.37
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500287.45
LogP ≤ 55.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-(decylamino)-1H-inden-2-ol?
The IUPAC name of 1-(decylamino)-1H-inden-2-ol (CID 151837661) is 1-(decylamino)-1H-inden-2-ol.
What is the SMILES notation for 1-(decylamino)-1H-inden-2-ol?
The canonical SMILES for 1-(decylamino)-1H-inden-2-ol is CCCCCCCCCCNC1C(O)=Cc2ccccc21.
What is the InChIKey of 1-(decylamino)-1H-inden-2-ol?
The InChIKey is SFZPTESTFLKRST-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29NO/c1-2-3-4-5-6-7-8-11-14-20-19-17-13-10-9-12-16(17)15-18(19)21/h9-10,12-13,15,19-21H,2-8,11,14H2,1H3.
What are the key properties of 1-(decylamino)-1H-inden-2-ol?
1-(decylamino)-1H-inden-2-ol has a molecular weight of 287.45 g/mol, XLogP of 5.37, 10 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(decylamino)-1H-inden-2-ol is sourced from PubChem (CID 151837661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).