1-(1-cyclopentylindol-5-yl)-2-methylpropan-2-ol

C17H23NO — CID 115115482

IUPAC1-(1-cyclopentylindol-5-yl)-2-methylpropan-2-ol
SMILESCC(C)(O)Cc1ccc2c(ccn2C2CCCC2)c1
InChIInChI=1S/C17H23NO/c1-17(2,19)12-13-7-8-16-14(11-13)9-10-18(16)15-5-3-4-6-15/h7-11,15,19H,3-6,12H2,1-2H3
InChIKeyRFUTZEIMNXPNOB-UHFFFAOYSA-N
MW257.38 g/mol
LogP4.07
Rot. Bonds3

About 1-(1-cyclopentylindol-5-yl)-2-methylpropan-2-ol

1-(1-cyclopentylindol-5-yl)-2-methylpropan-2-ol (PubChem CID 115115482) has the molecular formula C17H23NO and a molecular weight of 257.38 g/mol. Its IUPAC name is 1-(1-cyclopentylindol-5-yl)-2-methylpropan-2-ol.

Molecular Properties

Compound Name1-(1-cyclopentylindol-5-yl)-2-methylpropan-2-ol
PubChem CID115115482
Molecular FormulaC17H23NO
Molecular Weight257.38 g/mol
Exact Mass257.18
IUPAC Name1-(1-cyclopentylindol-5-yl)-2-methylpropan-2-ol
SMILESCC(C)(O)Cc1ccc2c(ccn2C2CCCC2)c1
InChIInChI=1S/C17H23NO/c1-17(2,19)12-13-7-8-16-14(11-13)9-10-18(16)15-5-3-4-6-15/h7-11,15,19H,3-6,12H2,1-2H3
InChIKeyRFUTZEIMNXPNOB-UHFFFAOYSA-N
XLogP4.07
TPSA25.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.38
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(1-cyclopentylindol-5-yl)-2-methylpropan-2-ol?
The IUPAC name of 1-(1-cyclopentylindol-5-yl)-2-methylpropan-2-ol (CID 115115482) is 1-(1-cyclopentylindol-5-yl)-2-methylpropan-2-ol.
What is the SMILES notation for 1-(1-cyclopentylindol-5-yl)-2-methylpropan-2-ol?
The canonical SMILES for 1-(1-cyclopentylindol-5-yl)-2-methylpropan-2-ol is CC(C)(O)Cc1ccc2c(ccn2C2CCCC2)c1.
What is the InChIKey of 1-(1-cyclopentylindol-5-yl)-2-methylpropan-2-ol?
The InChIKey is RFUTZEIMNXPNOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23NO/c1-17(2,19)12-13-7-8-16-14(11-13)9-10-18(16)15-5-3-4-6-15/h7-11,15,19H,3-6,12H2,1-2H3.
What are the key properties of 1-(1-cyclopentylindol-5-yl)-2-methylpropan-2-ol?
1-(1-cyclopentylindol-5-yl)-2-methylpropan-2-ol has a molecular weight of 257.38 g/mol, XLogP of 4.07, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-cyclopentylindol-5-yl)-2-methylpropan-2-ol is sourced from PubChem (CID 115115482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).