cyclopentyl N-(oxetan-3-yl)carbamate

C9H15NO3 — CID 129131220

IUPACcyclopentyl N-(oxetan-3-yl)carbamate
SMILESO=C(NC1COC1)OC1CCCC1
InChIInChI=1S/C9H15NO3/c11-9(10-7-5-12-6-7)13-8-3-1-2-4-8/h7-8H,1-6H2,(H,10,11)
InChIKeyRENPFTXEFDNSSL-UHFFFAOYSA-N
MW185.22 g/mol
LogP1.05
Rot. Bonds2

About cyclopentyl N-(oxetan-3-yl)carbamate

cyclopentyl N-(oxetan-3-yl)carbamate (PubChem CID 129131220) has the molecular formula C9H15NO3 and a molecular weight of 185.22 g/mol. Its IUPAC name is cyclopentyl N-(oxetan-3-yl)carbamate.

Molecular Properties

Compound Namecyclopentyl N-(oxetan-3-yl)carbamate
PubChem CID129131220
Molecular FormulaC9H15NO3
Molecular Weight185.22 g/mol
Exact Mass185.11
IUPAC Namecyclopentyl N-(oxetan-3-yl)carbamate
SMILESO=C(NC1COC1)OC1CCCC1
InChIInChI=1S/C9H15NO3/c11-9(10-7-5-12-6-7)13-8-3-1-2-4-8/h7-8H,1-6H2,(H,10,11)
InChIKeyRENPFTXEFDNSSL-UHFFFAOYSA-N
XLogP1.05
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.22
LogP ≤ 51.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of cyclopentyl N-(oxetan-3-yl)carbamate?
The IUPAC name of cyclopentyl N-(oxetan-3-yl)carbamate (CID 129131220) is cyclopentyl N-(oxetan-3-yl)carbamate.
What is the SMILES notation for cyclopentyl N-(oxetan-3-yl)carbamate?
The canonical SMILES for cyclopentyl N-(oxetan-3-yl)carbamate is O=C(NC1COC1)OC1CCCC1.
What is the InChIKey of cyclopentyl N-(oxetan-3-yl)carbamate?
The InChIKey is RENPFTXEFDNSSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO3/c11-9(10-7-5-12-6-7)13-8-3-1-2-4-8/h7-8H,1-6H2,(H,10,11).
What are the key properties of cyclopentyl N-(oxetan-3-yl)carbamate?
cyclopentyl N-(oxetan-3-yl)carbamate has a molecular weight of 185.22 g/mol, XLogP of 1.05, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentyl N-(oxetan-3-yl)carbamate is sourced from PubChem (CID 129131220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).