[6,6-dimethyl-4-[[5-methyl-2-(methylamino)cyclohexyl]methyl]morpholin-2-yl]methanol

C16H32N2O2 — CID 114780317

IUPAC[6,6-dimethyl-4-[[5-methyl-2-(methylamino)cyclohexyl]methyl]morpholin-2-yl]methanol
SMILESCNC1CCC(C)CC1CN1CC(CO)OC(C)(C)C1
InChIInChI=1S/C16H32N2O2/c1-12-5-6-15(17-4)13(7-12)8-18-9-14(10-19)20-16(2,3)11-18/h12-15,17,19H,5-11H2,1-4H3
InChIKeyYVMTWEIMDCDALV-UHFFFAOYSA-N
MW284.44 g/mol
LogP1.48
Rot. Bonds4

About [6,6-dimethyl-4-[[5-methyl-2-(methylamino)cyclohexyl]methyl]morpholin-2-yl]methanol

[6,6-dimethyl-4-[[5-methyl-2-(methylamino)cyclohexyl]methyl]morpholin-2-yl]methanol (PubChem CID 114780317) has the molecular formula C16H32N2O2 and a molecular weight of 284.44 g/mol. Its IUPAC name is [6,6-dimethyl-4-[[5-methyl-2-(methylamino)cyclohexyl]methyl]morpholin-2-yl]methanol.

Molecular Properties

Compound Name[6,6-dimethyl-4-[[5-methyl-2-(methylamino)cyclohexyl]methyl]morpholin-2-yl]methanol
PubChem CID114780317
Molecular FormulaC16H32N2O2
Molecular Weight284.44 g/mol
Exact Mass284.25
IUPAC Name[6,6-dimethyl-4-[[5-methyl-2-(methylamino)cyclohexyl]methyl]morpholin-2-yl]methanol
SMILESCNC1CCC(C)CC1CN1CC(CO)OC(C)(C)C1
InChIInChI=1S/C16H32N2O2/c1-12-5-6-15(17-4)13(7-12)8-18-9-14(10-19)20-16(2,3)11-18/h12-15,17,19H,5-11H2,1-4H3
InChIKeyYVMTWEIMDCDALV-UHFFFAOYSA-N
XLogP1.48
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.44
LogP ≤ 51.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [6,6-dimethyl-4-[[5-methyl-2-(methylamino)cyclohexyl]methyl]morpholin-2-yl]methanol?
The IUPAC name of [6,6-dimethyl-4-[[5-methyl-2-(methylamino)cyclohexyl]methyl]morpholin-2-yl]methanol (CID 114780317) is [6,6-dimethyl-4-[[5-methyl-2-(methylamino)cyclohexyl]methyl]morpholin-2-yl]methanol.
What is the SMILES notation for [6,6-dimethyl-4-[[5-methyl-2-(methylamino)cyclohexyl]methyl]morpholin-2-yl]methanol?
The canonical SMILES for [6,6-dimethyl-4-[[5-methyl-2-(methylamino)cyclohexyl]methyl]morpholin-2-yl]methanol is CNC1CCC(C)CC1CN1CC(CO)OC(C)(C)C1.
What is the InChIKey of [6,6-dimethyl-4-[[5-methyl-2-(methylamino)cyclohexyl]methyl]morpholin-2-yl]methanol?
The InChIKey is YVMTWEIMDCDALV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O2/c1-12-5-6-15(17-4)13(7-12)8-18-9-14(10-19)20-16(2,3)11-18/h12-15,17,19H,5-11H2,1-4H3.
What are the key properties of [6,6-dimethyl-4-[[5-methyl-2-(methylamino)cyclohexyl]methyl]morpholin-2-yl]methanol?
[6,6-dimethyl-4-[[5-methyl-2-(methylamino)cyclohexyl]methyl]morpholin-2-yl]methanol has a molecular weight of 284.44 g/mol, XLogP of 1.48, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [6,6-dimethyl-4-[[5-methyl-2-(methylamino)cyclohexyl]methyl]morpholin-2-yl]methanol is sourced from PubChem (CID 114780317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).