cyclopentyl N-[(4-ethylmorpholin-2-yl)methyl]carbamate

C13H24N2O3 — CID 112738868

IUPACcyclopentyl N-[(4-ethylmorpholin-2-yl)methyl]carbamate
SMILESCCN1CCOC(CNC(=O)OC2CCCC2)C1
InChIInChI=1S/C13H24N2O3/c1-2-15-7-8-17-12(10-15)9-14-13(16)18-11-5-3-4-6-11/h11-12H,2-10H2,1H3,(H,14,16)
InChIKeyZLONHUHIGIAJBZ-UHFFFAOYSA-N
MW256.35 g/mol
LogP1.38
Rot. Bonds4

About cyclopentyl N-[(4-ethylmorpholin-2-yl)methyl]carbamate

cyclopentyl N-[(4-ethylmorpholin-2-yl)methyl]carbamate (PubChem CID 112738868) has the molecular formula C13H24N2O3 and a molecular weight of 256.35 g/mol. Its IUPAC name is cyclopentyl N-[(4-ethylmorpholin-2-yl)methyl]carbamate.

Molecular Properties

Compound Namecyclopentyl N-[(4-ethylmorpholin-2-yl)methyl]carbamate
PubChem CID112738868
Molecular FormulaC13H24N2O3
Molecular Weight256.35 g/mol
Exact Mass256.18
IUPAC Namecyclopentyl N-[(4-ethylmorpholin-2-yl)methyl]carbamate
SMILESCCN1CCOC(CNC(=O)OC2CCCC2)C1
InChIInChI=1S/C13H24N2O3/c1-2-15-7-8-17-12(10-15)9-14-13(16)18-11-5-3-4-6-11/h11-12H,2-10H2,1H3,(H,14,16)
InChIKeyZLONHUHIGIAJBZ-UHFFFAOYSA-N
XLogP1.38
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of cyclopentyl N-[(4-ethylmorpholin-2-yl)methyl]carbamate?
The IUPAC name of cyclopentyl N-[(4-ethylmorpholin-2-yl)methyl]carbamate (CID 112738868) is cyclopentyl N-[(4-ethylmorpholin-2-yl)methyl]carbamate.
What is the SMILES notation for cyclopentyl N-[(4-ethylmorpholin-2-yl)methyl]carbamate?
The canonical SMILES for cyclopentyl N-[(4-ethylmorpholin-2-yl)methyl]carbamate is CCN1CCOC(CNC(=O)OC2CCCC2)C1.
What is the InChIKey of cyclopentyl N-[(4-ethylmorpholin-2-yl)methyl]carbamate?
The InChIKey is ZLONHUHIGIAJBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O3/c1-2-15-7-8-17-12(10-15)9-14-13(16)18-11-5-3-4-6-11/h11-12H,2-10H2,1H3,(H,14,16).
What are the key properties of cyclopentyl N-[(4-ethylmorpholin-2-yl)methyl]carbamate?
cyclopentyl N-[(4-ethylmorpholin-2-yl)methyl]carbamate has a molecular weight of 256.35 g/mol, XLogP of 1.38, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentyl N-[(4-ethylmorpholin-2-yl)methyl]carbamate is sourced from PubChem (CID 112738868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).