(2R)-1-(dimethylamino)-3,3-dimethylbutan-2-ol

C8H19NO — CID 58105895

IUPAC(2R)-1-(dimethylamino)-3,3-dimethylbutan-2-ol
SMILESCN(C)C[C@H](O)C(C)(C)C
InChIInChI=1S/C8H19NO/c1-8(2,3)7(10)6-9(4)5/h7,10H,6H2,1-5H3/t7-/m0/s1
InChIKeyFJKOWAMSBRKNAM-ZETCQYMHSA-N
MW145.25 g/mol
LogP0.95
Rot. Bonds2

About (2R)-1-(dimethylamino)-3,3-dimethylbutan-2-ol

(2R)-1-(dimethylamino)-3,3-dimethylbutan-2-ol (PubChem CID 58105895) has the molecular formula C8H19NO and a molecular weight of 145.25 g/mol. Its IUPAC name is (2R)-1-(dimethylamino)-3,3-dimethylbutan-2-ol.

Molecular Properties

Compound Name(2R)-1-(dimethylamino)-3,3-dimethylbutan-2-ol
PubChem CID58105895
Molecular FormulaC8H19NO
Molecular Weight145.25 g/mol
Exact Mass145.15
IUPAC Name(2R)-1-(dimethylamino)-3,3-dimethylbutan-2-ol
SMILESCN(C)C[C@H](O)C(C)(C)C
InChIInChI=1S/C8H19NO/c1-8(2,3)7(10)6-9(4)5/h7,10H,6H2,1-5H3/t7-/m0/s1
InChIKeyFJKOWAMSBRKNAM-ZETCQYMHSA-N
XLogP0.95
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.25
LogP ≤ 50.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2R)-1-(dimethylamino)-3,3-dimethylbutan-2-ol?
The IUPAC name of (2R)-1-(dimethylamino)-3,3-dimethylbutan-2-ol (CID 58105895) is (2R)-1-(dimethylamino)-3,3-dimethylbutan-2-ol.
What is the SMILES notation for (2R)-1-(dimethylamino)-3,3-dimethylbutan-2-ol?
The canonical SMILES for (2R)-1-(dimethylamino)-3,3-dimethylbutan-2-ol is CN(C)C[C@H](O)C(C)(C)C.
What is the InChIKey of (2R)-1-(dimethylamino)-3,3-dimethylbutan-2-ol?
The InChIKey is FJKOWAMSBRKNAM-ZETCQYMHSA-N. The full InChI is InChI=1S/C8H19NO/c1-8(2,3)7(10)6-9(4)5/h7,10H,6H2,1-5H3/t7-/m0/s1.
What are the key properties of (2R)-1-(dimethylamino)-3,3-dimethylbutan-2-ol?
(2R)-1-(dimethylamino)-3,3-dimethylbutan-2-ol has a molecular weight of 145.25 g/mol, XLogP of 0.95, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-(dimethylamino)-3,3-dimethylbutan-2-ol is sourced from PubChem (CID 58105895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).