4-cyclohexyl-4-morpholin-4-ylbut-2-yn-1-ol

C14H23NO2 — CID 46184786

IUPAC4-cyclohexyl-4-morpholin-4-ylbut-2-yn-1-ol
SMILESOCC#CC(C1CCCCC1)N1CCOCC1
InChIInChI=1S/C14H23NO2/c16-10-4-7-14(13-5-2-1-3-6-13)15-8-11-17-12-9-15/h13-14,16H,1-3,5-6,8-12H2
InChIKeyLAZIHNSKLMUQOL-UHFFFAOYSA-N
MW237.34 g/mol
LogP1.26
Rot. Bonds2

About 4-cyclohexyl-4-morpholin-4-ylbut-2-yn-1-ol

4-cyclohexyl-4-morpholin-4-ylbut-2-yn-1-ol (PubChem CID 46184786) has the molecular formula C14H23NO2 and a molecular weight of 237.34 g/mol. Its IUPAC name is 4-cyclohexyl-4-morpholin-4-ylbut-2-yn-1-ol.

Molecular Properties

Compound Name4-cyclohexyl-4-morpholin-4-ylbut-2-yn-1-ol
PubChem CID46184786
Molecular FormulaC14H23NO2
Molecular Weight237.34 g/mol
Exact Mass237.17
IUPAC Name4-cyclohexyl-4-morpholin-4-ylbut-2-yn-1-ol
SMILESOCC#CC(C1CCCCC1)N1CCOCC1
InChIInChI=1S/C14H23NO2/c16-10-4-7-14(13-5-2-1-3-6-13)15-8-11-17-12-9-15/h13-14,16H,1-3,5-6,8-12H2
InChIKeyLAZIHNSKLMUQOL-UHFFFAOYSA-N
XLogP1.26
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.34
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-(1-Cyclohexyl-3-cyclopropylprop-2-ynyl)morpholine
CID 46184788
4-(2-Cyclohexylethyl)-3-methylmorpholine
CID 57008137
4-(1-Cyclohexylethyl)morpholine
CID 57202414
[(3R)-4-(4-propan-2-ylcyclohexyl)morpholin-3-yl]methanol
CID 140709120
[(3S)-4-(4-propan-2-ylcyclohexyl)morpholin-3-yl]methanol
CID 140709151
4-(4-Propan-2-ylcyclohexyl)morpholin-1-ium
CID 147375805
4-(1-Cyclohexylnon-2-ynyl)morpholine
CID 46184785
[4-(4-Methylcyclohexyl)morpholin-3-yl]methanol
CID 83835375
4-(1,3-Dicyclohexylprop-2-ynyl)morpholine
CID 102165172
[4-(2-Ethylcyclohexyl)morpholin-3-yl]methanol
CID 116444477
[4-(Cyclohexylmethyl)morpholin-3-yl]methanol
CID 116444508
[4-(3-Ethylcyclohexyl)morpholin-3-yl]methanol
CID 116444817

Frequently Asked Questions

What is the IUPAC name of 4-cyclohexyl-4-morpholin-4-ylbut-2-yn-1-ol?
The IUPAC name of 4-cyclohexyl-4-morpholin-4-ylbut-2-yn-1-ol (CID 46184786) is 4-cyclohexyl-4-morpholin-4-ylbut-2-yn-1-ol.
What is the SMILES notation for 4-cyclohexyl-4-morpholin-4-ylbut-2-yn-1-ol?
The canonical SMILES for 4-cyclohexyl-4-morpholin-4-ylbut-2-yn-1-ol is OCC#CC(C1CCCCC1)N1CCOCC1.
What is the InChIKey of 4-cyclohexyl-4-morpholin-4-ylbut-2-yn-1-ol?
The InChIKey is LAZIHNSKLMUQOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO2/c16-10-4-7-14(13-5-2-1-3-6-13)15-8-11-17-12-9-15/h13-14,16H,1-3,5-6,8-12H2.
What are the key properties of 4-cyclohexyl-4-morpholin-4-ylbut-2-yn-1-ol?
4-cyclohexyl-4-morpholin-4-ylbut-2-yn-1-ol has a molecular weight of 237.34 g/mol, XLogP of 1.26, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclohexyl-4-morpholin-4-ylbut-2-yn-1-ol is sourced from PubChem (CID 46184786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).