(2R)-2-(dimethylamino)-3-methylbutan-1-ol

C7H17NO — CID 93492101

IUPAC(2R)-2-(dimethylamino)-3-methylbutan-1-ol
SMILESCC(C)[C@H](CO)N(C)C
InChIInChI=1S/C7H17NO/c1-6(2)7(5-9)8(3)4/h6-7,9H,5H2,1-4H3/t7-/m0/s1
InChIKeyIJCTUOXPCFLJLV-ZETCQYMHSA-N
MW131.22 g/mol
LogP0.56
Rot. Bonds3

About (2R)-2-(dimethylamino)-3-methylbutan-1-ol

(2R)-2-(dimethylamino)-3-methylbutan-1-ol (PubChem CID 93492101) has the molecular formula C7H17NO and a molecular weight of 131.22 g/mol. Its IUPAC name is (2R)-2-(dimethylamino)-3-methylbutan-1-ol.

Molecular Properties

Compound Name(2R)-2-(dimethylamino)-3-methylbutan-1-ol
PubChem CID93492101
Molecular FormulaC7H17NO
Molecular Weight131.22 g/mol
Exact Mass131.13
IUPAC Name(2R)-2-(dimethylamino)-3-methylbutan-1-ol
SMILESCC(C)[C@H](CO)N(C)C
InChIInChI=1S/C7H17NO/c1-6(2)7(5-9)8(3)4/h6-7,9H,5H2,1-4H3/t7-/m0/s1
InChIKeyIJCTUOXPCFLJLV-ZETCQYMHSA-N
XLogP0.56
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.22
LogP ≤ 50.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-(dimethylamino)-3-methylbutan-1-ol?
The IUPAC name of (2R)-2-(dimethylamino)-3-methylbutan-1-ol (CID 93492101) is (2R)-2-(dimethylamino)-3-methylbutan-1-ol.
What is the SMILES notation for (2R)-2-(dimethylamino)-3-methylbutan-1-ol?
The canonical SMILES for (2R)-2-(dimethylamino)-3-methylbutan-1-ol is CC(C)[C@H](CO)N(C)C.
What is the InChIKey of (2R)-2-(dimethylamino)-3-methylbutan-1-ol?
The InChIKey is IJCTUOXPCFLJLV-ZETCQYMHSA-N. The full InChI is InChI=1S/C7H17NO/c1-6(2)7(5-9)8(3)4/h6-7,9H,5H2,1-4H3/t7-/m0/s1.
What are the key properties of (2R)-2-(dimethylamino)-3-methylbutan-1-ol?
(2R)-2-(dimethylamino)-3-methylbutan-1-ol has a molecular weight of 131.22 g/mol, XLogP of 0.56, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(dimethylamino)-3-methylbutan-1-ol is sourced from PubChem (CID 93492101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).