cyclopentyl N-(1-methylindol-5-yl)carbamate

C15H18N2O2 — CID 54487481

IUPACcyclopentyl N-(1-methylindol-5-yl)carbamate
SMILESCn1ccc2cc(NC(=O)OC3CCCC3)ccc21
InChIInChI=1S/C15H18N2O2/c1-17-9-8-11-10-12(6-7-14(11)17)16-15(18)19-13-4-2-3-5-13/h6-10,13H,2-5H2,1H3,(H,16,18)
InChIKeyXTIMJVRQQJLWLL-UHFFFAOYSA-N
MW258.32 g/mol
LogP3.67
Rot. Bonds2

About cyclopentyl N-(1-methylindol-5-yl)carbamate

cyclopentyl N-(1-methylindol-5-yl)carbamate (PubChem CID 54487481) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is cyclopentyl N-(1-methylindol-5-yl)carbamate.

Molecular Properties

Compound Namecyclopentyl N-(1-methylindol-5-yl)carbamate
PubChem CID54487481
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC Namecyclopentyl N-(1-methylindol-5-yl)carbamate
SMILESCn1ccc2cc(NC(=O)OC3CCCC3)ccc21
InChIInChI=1S/C15H18N2O2/c1-17-9-8-11-10-12(6-7-14(11)17)16-15(18)19-13-4-2-3-5-13/h6-10,13H,2-5H2,1H3,(H,16,18)
InChIKeyXTIMJVRQQJLWLL-UHFFFAOYSA-N
XLogP3.67
TPSA43.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of cyclopentyl N-(1-methylindol-5-yl)carbamate?
The IUPAC name of cyclopentyl N-(1-methylindol-5-yl)carbamate (CID 54487481) is cyclopentyl N-(1-methylindol-5-yl)carbamate.
What is the SMILES notation for cyclopentyl N-(1-methylindol-5-yl)carbamate?
The canonical SMILES for cyclopentyl N-(1-methylindol-5-yl)carbamate is Cn1ccc2cc(NC(=O)OC3CCCC3)ccc21.
What is the InChIKey of cyclopentyl N-(1-methylindol-5-yl)carbamate?
The InChIKey is XTIMJVRQQJLWLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c1-17-9-8-11-10-12(6-7-14(11)17)16-15(18)19-13-4-2-3-5-13/h6-10,13H,2-5H2,1H3,(H,16,18).
What are the key properties of cyclopentyl N-(1-methylindol-5-yl)carbamate?
cyclopentyl N-(1-methylindol-5-yl)carbamate has a molecular weight of 258.32 g/mol, XLogP of 3.67, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentyl N-(1-methylindol-5-yl)carbamate is sourced from PubChem (CID 54487481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).