(2-methyl-2-morpholin-4-ylcyclopropyl)-pyrrolidin-1-ylmethanone

C13H22N2O2 — CID 70540425

IUPAC(2-methyl-2-morpholin-4-ylcyclopropyl)-pyrrolidin-1-ylmethanone
SMILESCC1(N2CCOCC2)CC1C(=O)N1CCCC1
InChIInChI=1S/C13H22N2O2/c1-13(15-6-8-17-9-7-15)10-11(13)12(16)14-4-2-3-5-14/h11H,2-10H2,1H3
InChIKeyWESDGNNDXDTGQF-UHFFFAOYSA-N
MW238.33 g/mol
LogP0.72
Rot. Bonds2

About (2-methyl-2-morpholin-4-ylcyclopropyl)-pyrrolidin-1-ylmethanone

(2-methyl-2-morpholin-4-ylcyclopropyl)-pyrrolidin-1-ylmethanone (PubChem CID 70540425) has the molecular formula C13H22N2O2 and a molecular weight of 238.33 g/mol. Its IUPAC name is (2-methyl-2-morpholin-4-ylcyclopropyl)-pyrrolidin-1-ylmethanone.

Molecular Properties

Compound Name(2-methyl-2-morpholin-4-ylcyclopropyl)-pyrrolidin-1-ylmethanone
PubChem CID70540425
Molecular FormulaC13H22N2O2
Molecular Weight238.33 g/mol
Exact Mass238.17
IUPAC Name(2-methyl-2-morpholin-4-ylcyclopropyl)-pyrrolidin-1-ylmethanone
SMILESCC1(N2CCOCC2)CC1C(=O)N1CCCC1
InChIInChI=1S/C13H22N2O2/c1-13(15-6-8-17-9-7-15)10-11(13)12(16)14-4-2-3-5-14/h11H,2-10H2,1H3
InChIKeyWESDGNNDXDTGQF-UHFFFAOYSA-N
XLogP0.72
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 50.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2-methyl-2-morpholin-4-ylcyclopropyl)-pyrrolidin-1-ylmethanone?
The IUPAC name of (2-methyl-2-morpholin-4-ylcyclopropyl)-pyrrolidin-1-ylmethanone (CID 70540425) is (2-methyl-2-morpholin-4-ylcyclopropyl)-pyrrolidin-1-ylmethanone.
What is the SMILES notation for (2-methyl-2-morpholin-4-ylcyclopropyl)-pyrrolidin-1-ylmethanone?
The canonical SMILES for (2-methyl-2-morpholin-4-ylcyclopropyl)-pyrrolidin-1-ylmethanone is CC1(N2CCOCC2)CC1C(=O)N1CCCC1.
What is the InChIKey of (2-methyl-2-morpholin-4-ylcyclopropyl)-pyrrolidin-1-ylmethanone?
The InChIKey is WESDGNNDXDTGQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O2/c1-13(15-6-8-17-9-7-15)10-11(13)12(16)14-4-2-3-5-14/h11H,2-10H2,1H3.
What are the key properties of (2-methyl-2-morpholin-4-ylcyclopropyl)-pyrrolidin-1-ylmethanone?
(2-methyl-2-morpholin-4-ylcyclopropyl)-pyrrolidin-1-ylmethanone has a molecular weight of 238.33 g/mol, XLogP of 0.72, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methyl-2-morpholin-4-ylcyclopropyl)-pyrrolidin-1-ylmethanone is sourced from PubChem (CID 70540425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).