4-(3-bicyclo[3.1.0]hexanyl)-3-methylmorpholine

C11H19NO — CID 144865906

IUPAC4-(3-bicyclo[3.1.0]hexanyl)-3-methylmorpholine
SMILESCC1COCCN1C1CC2CC2C1
InChIInChI=1S/C11H19NO/c1-8-7-13-3-2-12(8)11-5-9-4-10(9)6-11/h8-11H,2-7H2,1H3
InChIKeyVMOVCGKCOPDOIH-UHFFFAOYSA-N
MW181.28 g/mol
LogP1.51
Rot. Bonds1

About 4-(3-bicyclo[3.1.0]hexanyl)-3-methylmorpholine

4-(3-bicyclo[3.1.0]hexanyl)-3-methylmorpholine (PubChem CID 144865906) has the molecular formula C11H19NO and a molecular weight of 181.28 g/mol. Its IUPAC name is 4-(3-bicyclo[3.1.0]hexanyl)-3-methylmorpholine.

Molecular Properties

Compound Name4-(3-bicyclo[3.1.0]hexanyl)-3-methylmorpholine
PubChem CID144865906
Molecular FormulaC11H19NO
Molecular Weight181.28 g/mol
Exact Mass181.15
IUPAC Name4-(3-bicyclo[3.1.0]hexanyl)-3-methylmorpholine
SMILESCC1COCCN1C1CC2CC2C1
InChIInChI=1S/C11H19NO/c1-8-7-13-3-2-12(8)11-5-9-4-10(9)6-11/h8-11H,2-7H2,1H3
InChIKeyVMOVCGKCOPDOIH-UHFFFAOYSA-N
XLogP1.51
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.28
LogP ≤ 51.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-cyclobutyl-3-methylmorpholine
CID 131084475
(3R)-4-(1-tert-butylpiperidin-4-yl)-3-methylmorpholine
CID 118531607
4-(3-methylmorpholin-4-yl)oxolan-2-one
CID 131085919
6,8-dimethyl-3,4,6,7,8,9,10,10a-octahydro-1H-[1,4]oxazino[4,3-a]azepine
CID 156794987
(3R)-3-methyl-4-piperidin-3-ylmorpholine
CID 130978960
3,4-dimethylmorpholine;ethane;4-methylmorpholine
CID 145315669
2-(3-methylmorpholin-4-yl)cyclooctan-1-amine
CID 43542065
(4R,8R,9aS)-4-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[2,1-c][1,4]oxazin-8-ol
CID 15681246
(2R,4R,6S)-6-methyl-4-[(3R)-3-oxoniomorpholin-4-yl]oxan-2-olate
CID 176698160
[1-(ethylamino)-3-(3-methylmorpholin-4-yl)cyclopentyl]methanol
CID 79655799
(3S,4R)-3,4-dimethyl-3,4,6,7,9,9a-hexahydro-1H-[1,4]oxazino[3,4-c][1,4]oxazine
CID 177261927
ethane;3-ethyl-4-(oxetan-3-yl)morpholine
CID 177200740

Frequently Asked Questions

What is the IUPAC name of 4-(3-bicyclo[3.1.0]hexanyl)-3-methylmorpholine?
The IUPAC name of 4-(3-bicyclo[3.1.0]hexanyl)-3-methylmorpholine (CID 144865906) is 4-(3-bicyclo[3.1.0]hexanyl)-3-methylmorpholine.
What is the SMILES notation for 4-(3-bicyclo[3.1.0]hexanyl)-3-methylmorpholine?
The canonical SMILES for 4-(3-bicyclo[3.1.0]hexanyl)-3-methylmorpholine is CC1COCCN1C1CC2CC2C1.
What is the InChIKey of 4-(3-bicyclo[3.1.0]hexanyl)-3-methylmorpholine?
The InChIKey is VMOVCGKCOPDOIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO/c1-8-7-13-3-2-12(8)11-5-9-4-10(9)6-11/h8-11H,2-7H2,1H3.
What are the key properties of 4-(3-bicyclo[3.1.0]hexanyl)-3-methylmorpholine?
4-(3-bicyclo[3.1.0]hexanyl)-3-methylmorpholine has a molecular weight of 181.28 g/mol, XLogP of 1.51, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-bicyclo[3.1.0]hexanyl)-3-methylmorpholine is sourced from PubChem (CID 144865906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).