2-[(dibutylamino)methyl]-2-methylbutan-1-ol

C14H31NO — CID 62270910

IUPAC2-[(dibutylamino)methyl]-2-methylbutan-1-ol
SMILESCCCCN(CCCC)CC(C)(CC)CO
InChIInChI=1S/C14H31NO/c1-5-8-10-15(11-9-6-2)12-14(4,7-3)13-16/h16H,5-13H2,1-4H3
InChIKeyRNDRPGJXFLPPFY-UHFFFAOYSA-N
MW229.41 g/mol
LogP3.30
Rot. Bonds10

About 2-[(dibutylamino)methyl]-2-methylbutan-1-ol

2-[(dibutylamino)methyl]-2-methylbutan-1-ol (PubChem CID 62270910) has the molecular formula C14H31NO and a molecular weight of 229.41 g/mol. Its IUPAC name is 2-[(dibutylamino)methyl]-2-methylbutan-1-ol.

Molecular Properties

Compound Name2-[(dibutylamino)methyl]-2-methylbutan-1-ol
PubChem CID62270910
Molecular FormulaC14H31NO
Molecular Weight229.41 g/mol
Exact Mass229.24
IUPAC Name2-[(dibutylamino)methyl]-2-methylbutan-1-ol
SMILESCCCCN(CCCC)CC(C)(CC)CO
InChIInChI=1S/C14H31NO/c1-5-8-10-15(11-9-6-2)12-14(4,7-3)13-16/h16H,5-13H2,1-4H3
InChIKeyRNDRPGJXFLPPFY-UHFFFAOYSA-N
XLogP3.30
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.41
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[[butyl(methyl)amino]methyl]-2-methylbutan-1-ol
CID 62271452
2-[(dipentylamino)methyl]-2-ethylpropane-1,3-diol
CID 54545518
2-[(dimethylamino)methyl]-2-methylbutan-1-ol
CID 62270560
1-[butyl-(2-hydroxy-2-methylpropyl)amino]-2-methylpropan-2-ol
CID 90370489
2-[[2-hydroxyethyl(methyl)amino]methyl]-2-methylbutan-1-ol
CID 62272245
2-[butyl-[2-methyl-2-[(propan-2-ylamino)methyl]pentyl]amino]ethanol
CID 62256428
N,N-dibutylbutan-1-amine;hydrogen peroxide
CID 87070191
2-[(dibutylamino)methyl]-2-ethylbutanoic acid
CID 62270470
2-[butyl(2-hydroxyethyl)amino]ethanol
CID 23103220
N-(2,2-dimethylpropyl)-N-undecylundecan-1-amine
CID 6426420
N,N-dibutyl-2-methyl-N'-propan-2-yl-2-propylpropane-1,3-diamine
CID 63483431
2,9-diethyl-2,9-dimethyldecane-1,10-diol
CID 3069679

Frequently Asked Questions

What is the IUPAC name of 2-[(dibutylamino)methyl]-2-methylbutan-1-ol?
The IUPAC name of 2-[(dibutylamino)methyl]-2-methylbutan-1-ol (CID 62270910) is 2-[(dibutylamino)methyl]-2-methylbutan-1-ol.
What is the SMILES notation for 2-[(dibutylamino)methyl]-2-methylbutan-1-ol?
The canonical SMILES for 2-[(dibutylamino)methyl]-2-methylbutan-1-ol is CCCCN(CCCC)CC(C)(CC)CO.
What is the InChIKey of 2-[(dibutylamino)methyl]-2-methylbutan-1-ol?
The InChIKey is RNDRPGJXFLPPFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H31NO/c1-5-8-10-15(11-9-6-2)12-14(4,7-3)13-16/h16H,5-13H2,1-4H3.
What are the key properties of 2-[(dibutylamino)methyl]-2-methylbutan-1-ol?
2-[(dibutylamino)methyl]-2-methylbutan-1-ol has a molecular weight of 229.41 g/mol, XLogP of 3.30, 10 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(dibutylamino)methyl]-2-methylbutan-1-ol is sourced from PubChem (CID 62270910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).