(2,6-dimethylmorpholin-4-yl)-(1-hydroxycyclopentyl)methanone

C12H21NO3 — CID 71885390

IUPAC(2,6-dimethylmorpholin-4-yl)-(1-hydroxycyclopentyl)methanone
SMILESCC1CN(C(=O)C2(O)CCCC2)CC(C)O1
InChIInChI=1S/C12H21NO3/c1-9-7-13(8-10(2)16-9)11(14)12(15)5-3-4-6-12/h9-10,15H,3-8H2,1-2H3
InChIKeyDNRQLAAWQZYZOV-UHFFFAOYSA-N
MW227.30 g/mol
LogP0.93
Rot. Bonds1

About (2,6-dimethylmorpholin-4-yl)-(1-hydroxycyclopentyl)methanone

(2,6-dimethylmorpholin-4-yl)-(1-hydroxycyclopentyl)methanone (PubChem CID 71885390) has the molecular formula C12H21NO3 and a molecular weight of 227.30 g/mol. Its IUPAC name is (2,6-dimethylmorpholin-4-yl)-(1-hydroxycyclopentyl)methanone.

Molecular Properties

Compound Name(2,6-dimethylmorpholin-4-yl)-(1-hydroxycyclopentyl)methanone
PubChem CID71885390
Molecular FormulaC12H21NO3
Molecular Weight227.30 g/mol
Exact Mass227.15
IUPAC Name(2,6-dimethylmorpholin-4-yl)-(1-hydroxycyclopentyl)methanone
SMILESCC1CN(C(=O)C2(O)CCCC2)CC(C)O1
InChIInChI=1S/C12H21NO3/c1-9-7-13(8-10(2)16-9)11(14)12(15)5-3-4-6-12/h9-10,15H,3-8H2,1-2H3
InChIKeyDNRQLAAWQZYZOV-UHFFFAOYSA-N
XLogP0.93
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.30
LogP ≤ 50.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2,6-dimethylmorpholin-4-yl)-(1-hydroxycyclopentyl)methanone?
The IUPAC name of (2,6-dimethylmorpholin-4-yl)-(1-hydroxycyclopentyl)methanone (CID 71885390) is (2,6-dimethylmorpholin-4-yl)-(1-hydroxycyclopentyl)methanone.
What is the SMILES notation for (2,6-dimethylmorpholin-4-yl)-(1-hydroxycyclopentyl)methanone?
The canonical SMILES for (2,6-dimethylmorpholin-4-yl)-(1-hydroxycyclopentyl)methanone is CC1CN(C(=O)C2(O)CCCC2)CC(C)O1.
What is the InChIKey of (2,6-dimethylmorpholin-4-yl)-(1-hydroxycyclopentyl)methanone?
The InChIKey is DNRQLAAWQZYZOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21NO3/c1-9-7-13(8-10(2)16-9)11(14)12(15)5-3-4-6-12/h9-10,15H,3-8H2,1-2H3.
What are the key properties of (2,6-dimethylmorpholin-4-yl)-(1-hydroxycyclopentyl)methanone?
(2,6-dimethylmorpholin-4-yl)-(1-hydroxycyclopentyl)methanone has a molecular weight of 227.30 g/mol, XLogP of 0.93, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2,6-dimethylmorpholin-4-yl)-(1-hydroxycyclopentyl)methanone is sourced from PubChem (CID 71885390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).