cyclopentyl N-pyridin-3-ylcarbamate

C11H14N2O2 — CID 694562

IUPACcyclopentyl N-pyridin-3-ylcarbamate
SMILESO=C(Nc1cccnc1)OC1CCCC1
InChIInChI=1S/C11H14N2O2/c14-11(15-10-5-1-2-6-10)13-9-4-3-7-12-8-9/h3-4,7-8,10H,1-2,5-6H2,(H,13,14)
InChIKeyWDNPBNYZABVWBS-UHFFFAOYSA-N
MW206.25 g/mol
LogP2.57
Rot. Bonds2

About cyclopentyl N-pyridin-3-ylcarbamate

cyclopentyl N-pyridin-3-ylcarbamate (PubChem CID 694562) has the molecular formula C11H14N2O2 and a molecular weight of 206.25 g/mol. Its IUPAC name is cyclopentyl N-pyridin-3-ylcarbamate.

Molecular Properties

Compound Namecyclopentyl N-pyridin-3-ylcarbamate
PubChem CID694562
Molecular FormulaC11H14N2O2
Molecular Weight206.25 g/mol
Exact Mass206.11
IUPAC Namecyclopentyl N-pyridin-3-ylcarbamate
SMILESO=C(Nc1cccnc1)OC1CCCC1
InChIInChI=1S/C11H14N2O2/c14-11(15-10-5-1-2-6-10)13-9-4-3-7-12-8-9/h3-4,7-8,10H,1-2,5-6H2,(H,13,14)
InChIKeyWDNPBNYZABVWBS-UHFFFAOYSA-N
XLogP2.57
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.25
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of cyclopentyl N-pyridin-3-ylcarbamate?
The IUPAC name of cyclopentyl N-pyridin-3-ylcarbamate (CID 694562) is cyclopentyl N-pyridin-3-ylcarbamate.
What is the SMILES notation for cyclopentyl N-pyridin-3-ylcarbamate?
The canonical SMILES for cyclopentyl N-pyridin-3-ylcarbamate is O=C(Nc1cccnc1)OC1CCCC1.
What is the InChIKey of cyclopentyl N-pyridin-3-ylcarbamate?
The InChIKey is WDNPBNYZABVWBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O2/c14-11(15-10-5-1-2-6-10)13-9-4-3-7-12-8-9/h3-4,7-8,10H,1-2,5-6H2,(H,13,14).
What are the key properties of cyclopentyl N-pyridin-3-ylcarbamate?
cyclopentyl N-pyridin-3-ylcarbamate has a molecular weight of 206.25 g/mol, XLogP of 2.57, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentyl N-pyridin-3-ylcarbamate is sourced from PubChem (CID 694562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).