cyclopentyl(2,3-dihydro-1H-indol-5-yl)methanone

C14H17NO — CID 39243587

IUPACcyclopentyl(2,3-dihydro-1H-indol-5-yl)methanone
SMILESO=C(c1ccc2c(c1)CCN2)C1CCCC1
InChIInChI=1S/C14H17NO/c16-14(10-3-1-2-4-10)12-5-6-13-11(9-12)7-8-15-13/h5-6,9-10,15H,1-4,7-8H2
InChIKeyDJLZSQRGIAHFLD-UHFFFAOYSA-N
MW215.30 g/mol
LogP3.03
Rot. Bonds2

About cyclopentyl(2,3-dihydro-1H-indol-5-yl)methanone

cyclopentyl(2,3-dihydro-1H-indol-5-yl)methanone (PubChem CID 39243587) has the molecular formula C14H17NO and a molecular weight of 215.30 g/mol. Its IUPAC name is cyclopentyl(2,3-dihydro-1H-indol-5-yl)methanone.

Molecular Properties

Compound Namecyclopentyl(2,3-dihydro-1H-indol-5-yl)methanone
PubChem CID39243587
Molecular FormulaC14H17NO
Molecular Weight215.30 g/mol
Exact Mass215.13
IUPAC Namecyclopentyl(2,3-dihydro-1H-indol-5-yl)methanone
SMILESO=C(c1ccc2c(c1)CCN2)C1CCCC1
InChIInChI=1S/C14H17NO/c16-14(10-3-1-2-4-10)12-5-6-13-11(9-12)7-8-15-13/h5-6,9-10,15H,1-4,7-8H2
InChIKeyDJLZSQRGIAHFLD-UHFFFAOYSA-N
XLogP3.03
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of cyclopentyl(2,3-dihydro-1H-indol-5-yl)methanone?
The IUPAC name of cyclopentyl(2,3-dihydro-1H-indol-5-yl)methanone (CID 39243587) is cyclopentyl(2,3-dihydro-1H-indol-5-yl)methanone.
What is the SMILES notation for cyclopentyl(2,3-dihydro-1H-indol-5-yl)methanone?
The canonical SMILES for cyclopentyl(2,3-dihydro-1H-indol-5-yl)methanone is O=C(c1ccc2c(c1)CCN2)C1CCCC1.
What is the InChIKey of cyclopentyl(2,3-dihydro-1H-indol-5-yl)methanone?
The InChIKey is DJLZSQRGIAHFLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO/c16-14(10-3-1-2-4-10)12-5-6-13-11(9-12)7-8-15-13/h5-6,9-10,15H,1-4,7-8H2.
What are the key properties of cyclopentyl(2,3-dihydro-1H-indol-5-yl)methanone?
cyclopentyl(2,3-dihydro-1H-indol-5-yl)methanone has a molecular weight of 215.30 g/mol, XLogP of 3.03, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentyl(2,3-dihydro-1H-indol-5-yl)methanone is sourced from PubChem (CID 39243587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).