1-amino-2-methyl-4-(2,2,6,6-tetramethylmorpholin-4-yl)butan-2-ol

C13H28N2O2 — CID 102746437

IUPAC1-amino-2-methyl-4-(2,2,6,6-tetramethylmorpholin-4-yl)butan-2-ol
SMILESCC(O)(CN)CCN1CC(C)(C)OC(C)(C)C1
InChIInChI=1S/C13H28N2O2/c1-11(2)9-15(10-12(3,4)17-11)7-6-13(5,16)8-14/h16H,6-10,14H2,1-5H3
InChIKeyAOQRGMJAIWPJEE-UHFFFAOYSA-N
MW244.38 g/mol
LogP0.98
Rot. Bonds4

About 1-amino-2-methyl-4-(2,2,6,6-tetramethylmorpholin-4-yl)butan-2-ol

1-amino-2-methyl-4-(2,2,6,6-tetramethylmorpholin-4-yl)butan-2-ol (PubChem CID 102746437) has the molecular formula C13H28N2O2 and a molecular weight of 244.38 g/mol. Its IUPAC name is 1-amino-2-methyl-4-(2,2,6,6-tetramethylmorpholin-4-yl)butan-2-ol.

Molecular Properties

Compound Name1-amino-2-methyl-4-(2,2,6,6-tetramethylmorpholin-4-yl)butan-2-ol
PubChem CID102746437
Molecular FormulaC13H28N2O2
Molecular Weight244.38 g/mol
Exact Mass244.22
IUPAC Name1-amino-2-methyl-4-(2,2,6,6-tetramethylmorpholin-4-yl)butan-2-ol
SMILESCC(O)(CN)CCN1CC(C)(C)OC(C)(C)C1
InChIInChI=1S/C13H28N2O2/c1-11(2)9-15(10-12(3,4)17-11)7-6-13(5,16)8-14/h16H,6-10,14H2,1-5H3
InChIKeyAOQRGMJAIWPJEE-UHFFFAOYSA-N
XLogP0.98
TPSA58.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.38
LogP ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-4-(2,2,6,6-tetramethylmorpholin-4-yl)butan-2-ol
CID 102745123
2,2-dimethyl-4-(2,2,6,6-tetramethylmorpholin-4-yl)butanethioamide
CID 102743969
2,2-dimethyl-4-(2,2,6,6-tetramethylmorpholin-4-yl)butanimidamide
CID 102744138
2,2-dimethyl-4-(2,2,6,6-tetramethylmorpholin-4-yl)butanenitrile
CID 102743878
2-amino-2-methyl-6-(2,2,6,6-tetramethylmorpholin-4-yl)hexan-1-ol
CID 102746424
4-(2,2,6,6-tetramethylmorpholin-4-yl)butan-1-ol
CID 102745117
2,2-dimethyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)propan-1-ol
CID 102745863
1-amino-4-[4-(cyclopropylmethyl)piperazin-1-yl]-2-methylbutan-2-ol
CID 64821152
2,2-dimethyl-6-(2,2,6,6-tetramethylmorpholin-4-yl)hexanenitrile
CID 106710148
3-(2,2,6,6-tetramethylmorpholin-4-yl)propanoic acid
CID 102744515
3-(2,2,6,6-tetramethylmorpholin-4-yl)propanimidamide
CID 102744123
3,3-dimethyl-1-(2,2,6,6-tetramethylmorpholin-4-yl)butan-2-ol
CID 102745364

Frequently Asked Questions

What is the IUPAC name of 1-amino-2-methyl-4-(2,2,6,6-tetramethylmorpholin-4-yl)butan-2-ol?
The IUPAC name of 1-amino-2-methyl-4-(2,2,6,6-tetramethylmorpholin-4-yl)butan-2-ol (CID 102746437) is 1-amino-2-methyl-4-(2,2,6,6-tetramethylmorpholin-4-yl)butan-2-ol.
What is the SMILES notation for 1-amino-2-methyl-4-(2,2,6,6-tetramethylmorpholin-4-yl)butan-2-ol?
The canonical SMILES for 1-amino-2-methyl-4-(2,2,6,6-tetramethylmorpholin-4-yl)butan-2-ol is CC(O)(CN)CCN1CC(C)(C)OC(C)(C)C1.
What is the InChIKey of 1-amino-2-methyl-4-(2,2,6,6-tetramethylmorpholin-4-yl)butan-2-ol?
The InChIKey is AOQRGMJAIWPJEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O2/c1-11(2)9-15(10-12(3,4)17-11)7-6-13(5,16)8-14/h16H,6-10,14H2,1-5H3.
What are the key properties of 1-amino-2-methyl-4-(2,2,6,6-tetramethylmorpholin-4-yl)butan-2-ol?
1-amino-2-methyl-4-(2,2,6,6-tetramethylmorpholin-4-yl)butan-2-ol has a molecular weight of 244.38 g/mol, XLogP of 0.98, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-2-methyl-4-(2,2,6,6-tetramethylmorpholin-4-yl)butan-2-ol is sourced from PubChem (CID 102746437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).