[1-[[(4-methylmorpholin-2-yl)methylamino]methyl]cyclohexyl]methanol

C14H28N2O2 — CID 81419179

IUPAC[1-[[(4-methylmorpholin-2-yl)methylamino]methyl]cyclohexyl]methanol
SMILESCN1CCOC(CNCC2(CO)CCCCC2)C1
InChIInChI=1S/C14H28N2O2/c1-16-7-8-18-13(10-16)9-15-11-14(12-17)5-3-2-4-6-14/h13,15,17H,2-12H2,1H3
InChIKeyPMYVKDQSWBKZFJ-UHFFFAOYSA-N
MW256.39 g/mol
LogP0.85
Rot. Bonds5

About [1-[[(4-methylmorpholin-2-yl)methylamino]methyl]cyclohexyl]methanol

[1-[[(4-methylmorpholin-2-yl)methylamino]methyl]cyclohexyl]methanol (PubChem CID 81419179) has the molecular formula C14H28N2O2 and a molecular weight of 256.39 g/mol. Its IUPAC name is [1-[[(4-methylmorpholin-2-yl)methylamino]methyl]cyclohexyl]methanol.

Molecular Properties

Compound Name[1-[[(4-methylmorpholin-2-yl)methylamino]methyl]cyclohexyl]methanol
PubChem CID81419179
Molecular FormulaC14H28N2O2
Molecular Weight256.39 g/mol
Exact Mass256.22
IUPAC Name[1-[[(4-methylmorpholin-2-yl)methylamino]methyl]cyclohexyl]methanol
SMILESCN1CCOC(CNCC2(CO)CCCCC2)C1
InChIInChI=1S/C14H28N2O2/c1-16-7-8-18-13(10-16)9-15-11-14(12-17)5-3-2-4-6-14/h13,15,17H,2-12H2,1H3
InChIKeyPMYVKDQSWBKZFJ-UHFFFAOYSA-N
XLogP0.85
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 50.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [1-[[(4-methylmorpholin-2-yl)methylamino]methyl]cyclohexyl]methanol?
The IUPAC name of [1-[[(4-methylmorpholin-2-yl)methylamino]methyl]cyclohexyl]methanol (CID 81419179) is [1-[[(4-methylmorpholin-2-yl)methylamino]methyl]cyclohexyl]methanol.
What is the SMILES notation for [1-[[(4-methylmorpholin-2-yl)methylamino]methyl]cyclohexyl]methanol?
The canonical SMILES for [1-[[(4-methylmorpholin-2-yl)methylamino]methyl]cyclohexyl]methanol is CN1CCOC(CNCC2(CO)CCCCC2)C1.
What is the InChIKey of [1-[[(4-methylmorpholin-2-yl)methylamino]methyl]cyclohexyl]methanol?
The InChIKey is PMYVKDQSWBKZFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2/c1-16-7-8-18-13(10-16)9-15-11-14(12-17)5-3-2-4-6-14/h13,15,17H,2-12H2,1H3.
What are the key properties of [1-[[(4-methylmorpholin-2-yl)methylamino]methyl]cyclohexyl]methanol?
[1-[[(4-methylmorpholin-2-yl)methylamino]methyl]cyclohexyl]methanol has a molecular weight of 256.39 g/mol, XLogP of 0.85, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[[(4-methylmorpholin-2-yl)methylamino]methyl]cyclohexyl]methanol is sourced from PubChem (CID 81419179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).