1-(1-amino-3,3-dimethylbutan-2-yl)-3-methylpiperidin-4-ol

C12H26N2O — CID 114677908

IUPAC1-(1-amino-3,3-dimethylbutan-2-yl)-3-methylpiperidin-4-ol
SMILESCC1CN(C(CN)C(C)(C)C)CCC1O
InChIInChI=1S/C12H26N2O/c1-9-8-14(6-5-10(9)15)11(7-13)12(2,3)4/h9-11,15H,5-8,13H2,1-4H3
InChIKeyBQXINWRTGHLRCC-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.06
Rot. Bonds2

About 1-(1-amino-3,3-dimethylbutan-2-yl)-3-methylpiperidin-4-ol

1-(1-amino-3,3-dimethylbutan-2-yl)-3-methylpiperidin-4-ol (PubChem CID 114677908) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is 1-(1-amino-3,3-dimethylbutan-2-yl)-3-methylpiperidin-4-ol.

Molecular Properties

Compound Name1-(1-amino-3,3-dimethylbutan-2-yl)-3-methylpiperidin-4-ol
PubChem CID114677908
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC Name1-(1-amino-3,3-dimethylbutan-2-yl)-3-methylpiperidin-4-ol
SMILESCC1CN(C(CN)C(C)(C)C)CCC1O
InChIInChI=1S/C12H26N2O/c1-9-8-14(6-5-10(9)15)11(7-13)12(2,3)4/h9-11,15H,5-8,13H2,1-4H3
InChIKeyBQXINWRTGHLRCC-UHFFFAOYSA-N
XLogP1.06
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 51.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3,3-dimethyl-2-(3-morpholin-4-ylpyrrolidin-1-yl)butan-1-amine
CID 63171723
1-(3-amino-1,1,1-trifluorobutan-2-yl)-3-methylpiperidin-4-ol
CID 114677836
2-(azetidin-1-yl)-3,3-dimethylbutan-1-amine
CID 105430583
1-[2-amino-1-(5-methylfuran-2-yl)ethyl]-3-methylpiperidin-4-ol
CID 114678005
N'-hydroxy-3-(4-hydroxy-3-methylpiperidin-1-yl)butanimidamide
CID 104940928
3,3-dimethyl-2-(2-methylazetidin-1-yl)butan-1-amine
CID 130483921
2-(4-hydroxy-3-methylpiperidin-1-yl)propanenitrile
CID 114502562
4-(4-hydroxy-3-methylpiperidin-1-yl)pentanehydrazide
CID 114683804
1-[2-amino-1-(3-methylphenyl)ethyl]-3-methylpiperidin-4-ol
CID 114677976
3-(4-hydroxy-3-methylpiperidin-1-yl)pentanimidamide
CID 114678826
(3S,4R)-1-amino-3-methylpiperidin-4-ol
CID 129445696
1-(1-amino-3,3-dimethylbutan-2-yl)-3-methylpyrrolidin-3-ol
CID 103355425

Frequently Asked Questions

What is the IUPAC name of 1-(1-amino-3,3-dimethylbutan-2-yl)-3-methylpiperidin-4-ol?
The IUPAC name of 1-(1-amino-3,3-dimethylbutan-2-yl)-3-methylpiperidin-4-ol (CID 114677908) is 1-(1-amino-3,3-dimethylbutan-2-yl)-3-methylpiperidin-4-ol.
What is the SMILES notation for 1-(1-amino-3,3-dimethylbutan-2-yl)-3-methylpiperidin-4-ol?
The canonical SMILES for 1-(1-amino-3,3-dimethylbutan-2-yl)-3-methylpiperidin-4-ol is CC1CN(C(CN)C(C)(C)C)CCC1O.
What is the InChIKey of 1-(1-amino-3,3-dimethylbutan-2-yl)-3-methylpiperidin-4-ol?
The InChIKey is BQXINWRTGHLRCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-9-8-14(6-5-10(9)15)11(7-13)12(2,3)4/h9-11,15H,5-8,13H2,1-4H3.
What are the key properties of 1-(1-amino-3,3-dimethylbutan-2-yl)-3-methylpiperidin-4-ol?
1-(1-amino-3,3-dimethylbutan-2-yl)-3-methylpiperidin-4-ol has a molecular weight of 214.35 g/mol, XLogP of 1.06, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-amino-3,3-dimethylbutan-2-yl)-3-methylpiperidin-4-ol is sourced from PubChem (CID 114677908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).