7-bicyclo[4.1.0]heptanyl(morpholin-4-yl)methanone

C12H19NO2 — CID 23937529

IUPAC7-bicyclo[4.1.0]heptanyl(morpholin-4-yl)methanone
SMILESO=C(C1C2CCCCC21)N1CCOCC1
InChIInChI=1S/C12H19NO2/c14-12(13-5-7-15-8-6-13)11-9-3-1-2-4-10(9)11/h9-11H,1-8H2
InChIKeyOCAJSSPRIDSZBO-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.28
Rot. Bonds1

About 7-bicyclo[4.1.0]heptanyl(morpholin-4-yl)methanone

7-bicyclo[4.1.0]heptanyl(morpholin-4-yl)methanone (PubChem CID 23937529) has the molecular formula C12H19NO2 and a molecular weight of 209.29 g/mol. Its IUPAC name is 7-bicyclo[4.1.0]heptanyl(morpholin-4-yl)methanone.

Molecular Properties

Compound Name7-bicyclo[4.1.0]heptanyl(morpholin-4-yl)methanone
PubChem CID23937529
Molecular FormulaC12H19NO2
Molecular Weight209.29 g/mol
Exact Mass209.14
IUPAC Name7-bicyclo[4.1.0]heptanyl(morpholin-4-yl)methanone
SMILESO=C(C1C2CCCCC21)N1CCOCC1
InChIInChI=1S/C12H19NO2/c14-12(13-5-7-15-8-6-13)11-9-3-1-2-4-10(9)11/h9-11H,1-8H2
InChIKeyOCAJSSPRIDSZBO-UHFFFAOYSA-N
XLogP1.28
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Morpholin-4-yl(4-pentylcyclohexyl)methanone
CID 588415
(4-Hexylcyclohexyl)-morpholin-4-ylmethanone
CID 1719873
(1-Methyl-cyclohexyl)-morpholin-4-yl-methanone
CID 1103446
(4-Butylcyclohexyl)(morpholin-4-yl)methanone
CID 1719874
Cyclohexanecarboxylic acid, morpholide
CID 531815
3-Cyclohexyl-1-(morpholin-4-yl)propan-1-one
CID 887288
Morpholin-4-yl-tricyclo[4.3.1.1*3,8*]undec-3-yl-methanone
CID 653746
2-Cyclohexyl-1-(morpholin-4-yl)ethanone
CID 885486
Cyclohexyl(2,6-dimethylmorpholin-4-yl)methanone
CID 2915019
2-Cyclododecyl-1-(morpholin-4-yl)ethanone
CID 805516
4-(3-Cyclohexylpropanoyl)-2,6-dimethylmorpholine
CID 2939990
Morpholin-4-yl(tricyclo[4.3.1.1~3,8~]undec-1-yl)methanone
CID 3110953

Frequently Asked Questions

What is the IUPAC name of 7-bicyclo[4.1.0]heptanyl(morpholin-4-yl)methanone?
The IUPAC name of 7-bicyclo[4.1.0]heptanyl(morpholin-4-yl)methanone (CID 23937529) is 7-bicyclo[4.1.0]heptanyl(morpholin-4-yl)methanone.
What is the SMILES notation for 7-bicyclo[4.1.0]heptanyl(morpholin-4-yl)methanone?
The canonical SMILES for 7-bicyclo[4.1.0]heptanyl(morpholin-4-yl)methanone is O=C(C1C2CCCCC21)N1CCOCC1.
What is the InChIKey of 7-bicyclo[4.1.0]heptanyl(morpholin-4-yl)methanone?
The InChIKey is OCAJSSPRIDSZBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO2/c14-12(13-5-7-15-8-6-13)11-9-3-1-2-4-10(9)11/h9-11H,1-8H2.
What are the key properties of 7-bicyclo[4.1.0]heptanyl(morpholin-4-yl)methanone?
7-bicyclo[4.1.0]heptanyl(morpholin-4-yl)methanone has a molecular weight of 209.29 g/mol, XLogP of 1.28, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-bicyclo[4.1.0]heptanyl(morpholin-4-yl)methanone is sourced from PubChem (CID 23937529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).