2-(cyclohexen-1-yl)-1-morpholin-3-ylpropan-2-ol

C13H23NO2 — CID 106651593

IUPAC2-(cyclohexen-1-yl)-1-morpholin-3-ylpropan-2-ol
SMILESCC(O)(CC1COCCN1)C1=CCCCC1
InChIInChI=1S/C13H23NO2/c1-13(15,11-5-3-2-4-6-11)9-12-10-16-8-7-14-12/h5,12,14-15H,2-4,6-10H2,1H3
InChIKeyKBTDJBKEZSQNOG-UHFFFAOYSA-N
MW225.33 g/mol
LogP1.62
Rot. Bonds3

About 2-(cyclohexen-1-yl)-1-morpholin-3-ylpropan-2-ol

2-(cyclohexen-1-yl)-1-morpholin-3-ylpropan-2-ol (PubChem CID 106651593) has the molecular formula C13H23NO2 and a molecular weight of 225.33 g/mol. Its IUPAC name is 2-(cyclohexen-1-yl)-1-morpholin-3-ylpropan-2-ol.

Molecular Properties

Compound Name2-(cyclohexen-1-yl)-1-morpholin-3-ylpropan-2-ol
PubChem CID106651593
Molecular FormulaC13H23NO2
Molecular Weight225.33 g/mol
Exact Mass225.17
IUPAC Name2-(cyclohexen-1-yl)-1-morpholin-3-ylpropan-2-ol
SMILESCC(O)(CC1COCCN1)C1=CCCCC1
InChIInChI=1S/C13H23NO2/c1-13(15,11-5-3-2-4-6-11)9-12-10-16-8-7-14-12/h5,12,14-15H,2-4,6-10H2,1H3
InChIKeyKBTDJBKEZSQNOG-UHFFFAOYSA-N
XLogP1.62
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.33
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

(2Z,4S)-2-(2-methylpropylidene)-4-[(2S)-piperidin-2-yl]pentane-1,4-diol
CID 10868437
3-(Cyclohexen-1-yl)piperidin-3-ol
CID 106650907
2-(Cycloocten-1-yl)-1-piperidin-2-ylpropan-2-ol
CID 106651590
2-(Cyclohexen-1-yl)-1-piperidin-2-ylpropan-2-ol
CID 106651591
2-(Cyclohepten-1-yl)-1-piperidin-2-ylpropan-2-ol
CID 106651592
2-(Cyclohepten-1-yl)-1-morpholin-3-ylpropan-2-ol
CID 106651594
2-(Cyclohexen-1-yl)-4-(2-methoxyethylamino)butan-2-ol
CID 106654921
2-(Cyclohepten-1-yl)-4-(2-methoxyethylamino)butan-2-ol
CID 106654922
2-(Cyclohexen-1-yl)-1-(2-methoxyethylamino)propan-2-ol
CID 106654943
2-(Cyclohepten-1-yl)-1-(2-methoxyethylamino)propan-2-ol
CID 106654944
2-(Cycloocten-1-yl)-1-(2-methoxyethylamino)propan-2-ol
CID 106654945
2-(Cycloocten-1-yl)-1-morpholin-3-ylpropan-2-ol
CID 113860244

Frequently Asked Questions

What is the IUPAC name of 2-(cyclohexen-1-yl)-1-morpholin-3-ylpropan-2-ol?
The IUPAC name of 2-(cyclohexen-1-yl)-1-morpholin-3-ylpropan-2-ol (CID 106651593) is 2-(cyclohexen-1-yl)-1-morpholin-3-ylpropan-2-ol.
What is the SMILES notation for 2-(cyclohexen-1-yl)-1-morpholin-3-ylpropan-2-ol?
The canonical SMILES for 2-(cyclohexen-1-yl)-1-morpholin-3-ylpropan-2-ol is CC(O)(CC1COCCN1)C1=CCCCC1.
What is the InChIKey of 2-(cyclohexen-1-yl)-1-morpholin-3-ylpropan-2-ol?
The InChIKey is KBTDJBKEZSQNOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NO2/c1-13(15,11-5-3-2-4-6-11)9-12-10-16-8-7-14-12/h5,12,14-15H,2-4,6-10H2,1H3.
What are the key properties of 2-(cyclohexen-1-yl)-1-morpholin-3-ylpropan-2-ol?
2-(cyclohexen-1-yl)-1-morpholin-3-ylpropan-2-ol has a molecular weight of 225.33 g/mol, XLogP of 1.62, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclohexen-1-yl)-1-morpholin-3-ylpropan-2-ol is sourced from PubChem (CID 106651593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).