4-(dibutylamino)-2-methylbutan-2-ol

C13H29NO — CID 79361308

IUPAC4-(dibutylamino)-2-methylbutan-2-ol
SMILESCCCCN(CCCC)CCC(C)(C)O
InChIInChI=1S/C13H29NO/c1-5-7-10-14(11-8-6-2)12-9-13(3,4)15/h15H,5-12H2,1-4H3
InChIKeyORYJBBRPMXBONP-UHFFFAOYSA-N
MW215.38 g/mol
LogP3.05
Rot. Bonds9

About 4-(dibutylamino)-2-methylbutan-2-ol

4-(dibutylamino)-2-methylbutan-2-ol (PubChem CID 79361308) has the molecular formula C13H29NO and a molecular weight of 215.38 g/mol. Its IUPAC name is 4-(dibutylamino)-2-methylbutan-2-ol.

Molecular Properties

Compound Name4-(dibutylamino)-2-methylbutan-2-ol
PubChem CID79361308
Molecular FormulaC13H29NO
Molecular Weight215.38 g/mol
Exact Mass215.22
IUPAC Name4-(dibutylamino)-2-methylbutan-2-ol
SMILESCCCCN(CCCC)CCC(C)(C)O
InChIInChI=1S/C13H29NO/c1-5-7-10-14(11-8-6-2)12-9-13(3,4)15/h15H,5-12H2,1-4H3
InChIKeyORYJBBRPMXBONP-UHFFFAOYSA-N
XLogP3.05
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.38
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-(dibutylamino)-2-methylpentan-2-ol
CID 18944366
1-[butyl-(2-hydroxy-2-methylpropyl)amino]-2-methylpropan-2-ol
CID 90370489
N,N-dibutylbutan-1-amine;hydrogen peroxide
CID 87070191
N,N-dibutylbutan-1-amine;difluorophosphinic acid
CID 130422664
5-(diethylamino)-2-methylpentan-2-ol
CID 14530143
N,N-dibutylbutan-1-amine;trihydrate
CID 173345147
N,N-dibutylbutan-1-amine;tetrahydrate
CID 172865997
N,N,N',N'-tetrabutylethane-1,2-diamine
CID 5224972
2-methylhexan-2-ol;yttrium
CID 58823506
boric acid;bis(N,N-dibutylbutan-1-amine)
CID 172841761
gold;2-methylhexan-2-ol
CID 18513333
N,N-dibutylbutan-1-amine;molecular hydrogen
CID 174513596

Frequently Asked Questions

What is the IUPAC name of 4-(dibutylamino)-2-methylbutan-2-ol?
The IUPAC name of 4-(dibutylamino)-2-methylbutan-2-ol (CID 79361308) is 4-(dibutylamino)-2-methylbutan-2-ol.
What is the SMILES notation for 4-(dibutylamino)-2-methylbutan-2-ol?
The canonical SMILES for 4-(dibutylamino)-2-methylbutan-2-ol is CCCCN(CCCC)CCC(C)(C)O.
What is the InChIKey of 4-(dibutylamino)-2-methylbutan-2-ol?
The InChIKey is ORYJBBRPMXBONP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H29NO/c1-5-7-10-14(11-8-6-2)12-9-13(3,4)15/h15H,5-12H2,1-4H3.
What are the key properties of 4-(dibutylamino)-2-methylbutan-2-ol?
4-(dibutylamino)-2-methylbutan-2-ol has a molecular weight of 215.38 g/mol, XLogP of 3.05, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dibutylamino)-2-methylbutan-2-ol is sourced from PubChem (CID 79361308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).