3-(dimethylamino)-3-methylbutan-2-ol

C7H17NO — CID 59861746

IUPAC3-(dimethylamino)-3-methylbutan-2-ol
SMILESCC(O)C(C)(C)N(C)C
InChIInChI=1S/C7H17NO/c1-6(9)7(2,3)8(4)5/h6,9H,1-5H3
InChIKeyJLBLJBKKSIFSRR-UHFFFAOYSA-N
MW131.22 g/mol
LogP0.71
Rot. Bonds2

About 3-(dimethylamino)-3-methylbutan-2-ol

3-(dimethylamino)-3-methylbutan-2-ol (PubChem CID 59861746) has the molecular formula C7H17NO and a molecular weight of 131.22 g/mol. Its IUPAC name is 3-(dimethylamino)-3-methylbutan-2-ol.

Molecular Properties

Compound Name3-(dimethylamino)-3-methylbutan-2-ol
PubChem CID59861746
Molecular FormulaC7H17NO
Molecular Weight131.22 g/mol
Exact Mass131.13
IUPAC Name3-(dimethylamino)-3-methylbutan-2-ol
SMILESCC(O)C(C)(C)N(C)C
InChIInChI=1S/C7H17NO/c1-6(9)7(2,3)8(4)5/h6,9H,1-5H3
InChIKeyJLBLJBKKSIFSRR-UHFFFAOYSA-N
XLogP0.71
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.22
LogP ≤ 50.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(dimethylamino)-3-methylbutan-2-ol?
The IUPAC name of 3-(dimethylamino)-3-methylbutan-2-ol (CID 59861746) is 3-(dimethylamino)-3-methylbutan-2-ol.
What is the SMILES notation for 3-(dimethylamino)-3-methylbutan-2-ol?
The canonical SMILES for 3-(dimethylamino)-3-methylbutan-2-ol is CC(O)C(C)(C)N(C)C.
What is the InChIKey of 3-(dimethylamino)-3-methylbutan-2-ol?
The InChIKey is JLBLJBKKSIFSRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17NO/c1-6(9)7(2,3)8(4)5/h6,9H,1-5H3.
What are the key properties of 3-(dimethylamino)-3-methylbutan-2-ol?
3-(dimethylamino)-3-methylbutan-2-ol has a molecular weight of 131.22 g/mol, XLogP of 0.71, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylamino)-3-methylbutan-2-ol is sourced from PubChem (CID 59861746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).