3,3-dimethyl-1-(2,2,6,6-tetramethylmorpholin-4-yl)butan-2-ol

C14H29NO2 — CID 102745364

IUPAC3,3-dimethyl-1-(2,2,6,6-tetramethylmorpholin-4-yl)butan-2-ol
SMILESCC1(C)CN(CC(O)C(C)(C)C)CC(C)(C)O1
InChIInChI=1S/C14H29NO2/c1-12(2,3)11(16)8-15-9-13(4,5)17-14(6,7)10-15/h11,16H,8-10H2,1-7H3
InChIKeyMTPNTMXWJJLNCM-UHFFFAOYSA-N
MW243.39 g/mol
LogP2.28
Rot. Bonds2

About 3,3-dimethyl-1-(2,2,6,6-tetramethylmorpholin-4-yl)butan-2-ol

3,3-dimethyl-1-(2,2,6,6-tetramethylmorpholin-4-yl)butan-2-ol (PubChem CID 102745364) has the molecular formula C14H29NO2 and a molecular weight of 243.39 g/mol. Its IUPAC name is 3,3-dimethyl-1-(2,2,6,6-tetramethylmorpholin-4-yl)butan-2-ol.

Molecular Properties

Compound Name3,3-dimethyl-1-(2,2,6,6-tetramethylmorpholin-4-yl)butan-2-ol
PubChem CID102745364
Molecular FormulaC14H29NO2
Molecular Weight243.39 g/mol
Exact Mass243.22
IUPAC Name3,3-dimethyl-1-(2,2,6,6-tetramethylmorpholin-4-yl)butan-2-ol
SMILESCC1(C)CN(CC(O)C(C)(C)C)CC(C)(C)O1
InChIInChI=1S/C14H29NO2/c1-12(2,3)11(16)8-15-9-13(4,5)17-14(6,7)10-15/h11,16H,8-10H2,1-7H3
InChIKeyMTPNTMXWJJLNCM-UHFFFAOYSA-N
XLogP2.28
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.39
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyclopropyl-2-(2,2,6,6-tetramethylmorpholin-4-yl)ethanol
CID 102745370
2,2-dimethyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)propan-1-ol
CID 102745863
4-(2-bromo-3,3,3-trifluoropropyl)-2,2,6,6-tetramethylmorpholine
CID 102745273
2-methyl-4-(2,2,6,6-tetramethylmorpholin-4-yl)butan-2-ol
CID 102745123
3,3-dimethyl-1-(3-methylazetidin-1-yl)butan-2-ol
CID 130679235
1-(oxolan-3-yl)-2-(2,2,6,6-tetramethylmorpholin-4-yl)ethanol
CID 102745374
methyl 2-methyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)propanoate
CID 102744546
(2R)-1-(4-tert-butylpiperazin-1-yl)-3,3-dimethylbutan-2-ol
CID 146548382
2-methyl-1-phenyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)propan-1-ol
CID 102745849
2-methyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)propanehydrazide
CID 102746297
3-methyl-1-(2,2,6,6-tetramethylmorpholin-4-yl)pentan-2-amine
CID 102743395
1-(2-hydroxy-3,3-dimethylbutyl)piperidin-4-ol
CID 130501782

Frequently Asked Questions

What is the IUPAC name of 3,3-dimethyl-1-(2,2,6,6-tetramethylmorpholin-4-yl)butan-2-ol?
The IUPAC name of 3,3-dimethyl-1-(2,2,6,6-tetramethylmorpholin-4-yl)butan-2-ol (CID 102745364) is 3,3-dimethyl-1-(2,2,6,6-tetramethylmorpholin-4-yl)butan-2-ol.
What is the SMILES notation for 3,3-dimethyl-1-(2,2,6,6-tetramethylmorpholin-4-yl)butan-2-ol?
The canonical SMILES for 3,3-dimethyl-1-(2,2,6,6-tetramethylmorpholin-4-yl)butan-2-ol is CC1(C)CN(CC(O)C(C)(C)C)CC(C)(C)O1.
What is the InChIKey of 3,3-dimethyl-1-(2,2,6,6-tetramethylmorpholin-4-yl)butan-2-ol?
The InChIKey is MTPNTMXWJJLNCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO2/c1-12(2,3)11(16)8-15-9-13(4,5)17-14(6,7)10-15/h11,16H,8-10H2,1-7H3.
What are the key properties of 3,3-dimethyl-1-(2,2,6,6-tetramethylmorpholin-4-yl)butan-2-ol?
3,3-dimethyl-1-(2,2,6,6-tetramethylmorpholin-4-yl)butan-2-ol has a molecular weight of 243.39 g/mol, XLogP of 2.28, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-dimethyl-1-(2,2,6,6-tetramethylmorpholin-4-yl)butan-2-ol is sourced from PubChem (CID 102745364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).