1-methyl-2-morpholin-4-yl-4-prop-1-en-2-ylcyclohexan-1-ol

C14H25NO2 — CID 22625205

IUPAC1-methyl-2-morpholin-4-yl-4-prop-1-en-2-ylcyclohexan-1-ol
SMILESC=C(C)C1CCC(C)(O)C(N2CCOCC2)C1
InChIInChI=1S/C14H25NO2/c1-11(2)12-4-5-14(3,16)13(10-12)15-6-8-17-9-7-15/h12-13,16H,1,4-10H2,2-3H3
InChIKeyYTJVBLPAMBTDCH-UHFFFAOYSA-N
MW239.36 g/mol
LogP1.81
Rot. Bonds2

About 1-methyl-2-morpholin-4-yl-4-prop-1-en-2-ylcyclohexan-1-ol

1-methyl-2-morpholin-4-yl-4-prop-1-en-2-ylcyclohexan-1-ol (PubChem CID 22625205) has the molecular formula C14H25NO2 and a molecular weight of 239.36 g/mol. Its IUPAC name is 1-methyl-2-morpholin-4-yl-4-prop-1-en-2-ylcyclohexan-1-ol.

Molecular Properties

Compound Name1-methyl-2-morpholin-4-yl-4-prop-1-en-2-ylcyclohexan-1-ol
PubChem CID22625205
Molecular FormulaC14H25NO2
Molecular Weight239.36 g/mol
Exact Mass239.19
IUPAC Name1-methyl-2-morpholin-4-yl-4-prop-1-en-2-ylcyclohexan-1-ol
SMILESC=C(C)C1CCC(C)(O)C(N2CCOCC2)C1
InChIInChI=1S/C14H25NO2/c1-11(2)12-4-5-14(3,16)13(10-12)15-6-8-17-9-7-15/h12-13,16H,1,4-10H2,2-3H3
InChIKeyYTJVBLPAMBTDCH-UHFFFAOYSA-N
XLogP1.81
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

Cyclohexanol, 1-methyl-4-(1-methylethenyl)-2-(4-morpholinyl)-, (1R,2R,4S)-
CID 9856166
(1S,2S,4R)-2-(Dimethylamino)-1-methyl-4-(prop-1-en-2-yl)cyclohexan-1-ol
CID 10965481
(1S,2S,4R)-1-Methyl-2-(morpholin-4-yl)-4-(prop-1-en-2-yl)cyclohexan-1-ol
CID 15906519
(1S,2S,4R)-1-methyl-2-(4-methylpiperidin-1-yl)-4-prop-1-en-2-ylcyclohexan-1-ol
CID 15906526
(1S,2S,4R)-1-methyl-2-piperidin-1-yl-4-prop-1-en-2-ylcyclohexan-1-ol
CID 15906527
(1S,2S,4R)-1-methyl-2-(4-methylpiperazin-1-yl)-4-prop-1-en-2-ylcyclohexan-1-ol
CID 15906528
ethyl 1-[(1S,2S,5R)-2-hydroxy-2-methyl-5-prop-1-en-2-ylcyclohexyl]piperidine-4-carboxylate
CID 15906531
ethyl 1-[(1R,2R,5S)-2-hydroxy-2-methyl-5-prop-1-en-2-ylcyclohexyl]piperidine-4-carboxylate
CID 18714358
(2-Hydroxy-2-methyl-5-prop-1-en-2-ylcyclohexyl)-trimethylazanium
CID 18714367
2-(Diethylamino)-1-methyl-4-prop-1-en-2-ylcyclohexan-1-ol
CID 21532762
2-[Butyl(methyl)amino]-1-methyl-4-prop-1-en-2-ylcyclohexan-1-ol
CID 21532763
2-[Butyl(ethyl)amino]-1-methyl-4-prop-1-en-2-ylcyclohexan-1-ol
CID 21532764

Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-morpholin-4-yl-4-prop-1-en-2-ylcyclohexan-1-ol?
The IUPAC name of 1-methyl-2-morpholin-4-yl-4-prop-1-en-2-ylcyclohexan-1-ol (CID 22625205) is 1-methyl-2-morpholin-4-yl-4-prop-1-en-2-ylcyclohexan-1-ol.
What is the SMILES notation for 1-methyl-2-morpholin-4-yl-4-prop-1-en-2-ylcyclohexan-1-ol?
The canonical SMILES for 1-methyl-2-morpholin-4-yl-4-prop-1-en-2-ylcyclohexan-1-ol is C=C(C)C1CCC(C)(O)C(N2CCOCC2)C1.
What is the InChIKey of 1-methyl-2-morpholin-4-yl-4-prop-1-en-2-ylcyclohexan-1-ol?
The InChIKey is YTJVBLPAMBTDCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO2/c1-11(2)12-4-5-14(3,16)13(10-12)15-6-8-17-9-7-15/h12-13,16H,1,4-10H2,2-3H3.
What are the key properties of 1-methyl-2-morpholin-4-yl-4-prop-1-en-2-ylcyclohexan-1-ol?
1-methyl-2-morpholin-4-yl-4-prop-1-en-2-ylcyclohexan-1-ol has a molecular weight of 239.36 g/mol, XLogP of 1.81, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-morpholin-4-yl-4-prop-1-en-2-ylcyclohexan-1-ol is sourced from PubChem (CID 22625205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).