1-[1-(morpholin-4-ylmethyl)cyclopentyl]ethanone

C12H21NO2 — CID 90440432

IUPAC1-[1-(morpholin-4-ylmethyl)cyclopentyl]ethanone
SMILESCC(=O)C1(CN2CCOCC2)CCCC1
InChIInChI=1S/C12H21NO2/c1-11(14)12(4-2-3-5-12)10-13-6-8-15-9-7-13/h2-10H2,1H3
InChIKeyOHDNLBUXVYOWTI-UHFFFAOYSA-N
MW211.30 g/mol
LogP1.47
Rot. Bonds3

About 1-[1-(morpholin-4-ylmethyl)cyclopentyl]ethanone

1-[1-(morpholin-4-ylmethyl)cyclopentyl]ethanone (PubChem CID 90440432) has the molecular formula C12H21NO2 and a molecular weight of 211.30 g/mol. Its IUPAC name is 1-[1-(morpholin-4-ylmethyl)cyclopentyl]ethanone.

Molecular Properties

Compound Name1-[1-(morpholin-4-ylmethyl)cyclopentyl]ethanone
PubChem CID90440432
Molecular FormulaC12H21NO2
Molecular Weight211.30 g/mol
Exact Mass211.16
IUPAC Name1-[1-(morpholin-4-ylmethyl)cyclopentyl]ethanone
SMILESCC(=O)C1(CN2CCOCC2)CCCC1
InChIInChI=1S/C12H21NO2/c1-11(14)12(4-2-3-5-12)10-13-6-8-15-9-7-13/h2-10H2,1H3
InChIKeyOHDNLBUXVYOWTI-UHFFFAOYSA-N
XLogP1.47
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.30
LogP ≤ 51.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[1-(morpholin-4-ylmethyl)cyclopentyl]ethanone?
The IUPAC name of 1-[1-(morpholin-4-ylmethyl)cyclopentyl]ethanone (CID 90440432) is 1-[1-(morpholin-4-ylmethyl)cyclopentyl]ethanone.
What is the SMILES notation for 1-[1-(morpholin-4-ylmethyl)cyclopentyl]ethanone?
The canonical SMILES for 1-[1-(morpholin-4-ylmethyl)cyclopentyl]ethanone is CC(=O)C1(CN2CCOCC2)CCCC1.
What is the InChIKey of 1-[1-(morpholin-4-ylmethyl)cyclopentyl]ethanone?
The InChIKey is OHDNLBUXVYOWTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21NO2/c1-11(14)12(4-2-3-5-12)10-13-6-8-15-9-7-13/h2-10H2,1H3.
What are the key properties of 1-[1-(morpholin-4-ylmethyl)cyclopentyl]ethanone?
1-[1-(morpholin-4-ylmethyl)cyclopentyl]ethanone has a molecular weight of 211.30 g/mol, XLogP of 1.47, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(morpholin-4-ylmethyl)cyclopentyl]ethanone is sourced from PubChem (CID 90440432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).