1-(1-amino-2-methylbutan-2-yl)-2,2-dimethylcyclobutan-1-ol

C11H23NO — CID 130555536

IUPAC1-(1-amino-2-methylbutan-2-yl)-2,2-dimethylcyclobutan-1-ol
SMILESCCC(C)(CN)C1(O)CCC1(C)C
InChIInChI=1S/C11H23NO/c1-5-10(4,8-12)11(13)7-6-9(11,2)3/h13H,5-8,12H2,1-4H3
InChIKeyCKXMYSWRMKGMCN-UHFFFAOYSA-N
MW185.31 g/mol
LogP1.91
Rot. Bonds3

About 1-(1-amino-2-methylbutan-2-yl)-2,2-dimethylcyclobutan-1-ol

1-(1-amino-2-methylbutan-2-yl)-2,2-dimethylcyclobutan-1-ol (PubChem CID 130555536) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is 1-(1-amino-2-methylbutan-2-yl)-2,2-dimethylcyclobutan-1-ol.

Molecular Properties

Compound Name1-(1-amino-2-methylbutan-2-yl)-2,2-dimethylcyclobutan-1-ol
PubChem CID130555536
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Name1-(1-amino-2-methylbutan-2-yl)-2,2-dimethylcyclobutan-1-ol
SMILESCCC(C)(CN)C1(O)CCC1(C)C
InChIInChI=1S/C11H23NO/c1-5-10(4,8-12)11(13)7-6-9(11,2)3/h13H,5-8,12H2,1-4H3
InChIKeyCKXMYSWRMKGMCN-UHFFFAOYSA-N
XLogP1.91
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 79128658
4-(1-amino-2-methylbutan-2-yl)-3-ethylpiperidin-4-ol
CID 114510720
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2,2-dimethylpropan-1-amine;ethane;methanol
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3,3-dimethylpentane;ethane;methanol
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Frequently Asked Questions

What is the IUPAC name of 1-(1-amino-2-methylbutan-2-yl)-2,2-dimethylcyclobutan-1-ol?
The IUPAC name of 1-(1-amino-2-methylbutan-2-yl)-2,2-dimethylcyclobutan-1-ol (CID 130555536) is 1-(1-amino-2-methylbutan-2-yl)-2,2-dimethylcyclobutan-1-ol.
What is the SMILES notation for 1-(1-amino-2-methylbutan-2-yl)-2,2-dimethylcyclobutan-1-ol?
The canonical SMILES for 1-(1-amino-2-methylbutan-2-yl)-2,2-dimethylcyclobutan-1-ol is CCC(C)(CN)C1(O)CCC1(C)C.
What is the InChIKey of 1-(1-amino-2-methylbutan-2-yl)-2,2-dimethylcyclobutan-1-ol?
The InChIKey is CKXMYSWRMKGMCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-5-10(4,8-12)11(13)7-6-9(11,2)3/h13H,5-8,12H2,1-4H3.
What are the key properties of 1-(1-amino-2-methylbutan-2-yl)-2,2-dimethylcyclobutan-1-ol?
1-(1-amino-2-methylbutan-2-yl)-2,2-dimethylcyclobutan-1-ol has a molecular weight of 185.31 g/mol, XLogP of 1.91, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-amino-2-methylbutan-2-yl)-2,2-dimethylcyclobutan-1-ol is sourced from PubChem (CID 130555536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).