2-[[2-(tert-butylamino)-2-methylpropyl]amino]-2-methylpropan-1-ol

C12H28N2O — CID 58721712

IUPAC2-[[2-(tert-butylamino)-2-methylpropyl]amino]-2-methylpropan-1-ol
SMILESCC(C)(C)NC(C)(C)CNC(C)(C)CO
InChIInChI=1S/C12H28N2O/c1-10(2,3)14-11(4,5)8-13-12(6,7)9-15/h13-15H,8-9H2,1-7H3
InChIKeyORLISHRWDLMTJH-UHFFFAOYSA-N
MW216.37 g/mol
LogP1.51
Rot. Bonds5

About 2-[[2-(tert-butylamino)-2-methylpropyl]amino]-2-methylpropan-1-ol

2-[[2-(tert-butylamino)-2-methylpropyl]amino]-2-methylpropan-1-ol (PubChem CID 58721712) has the molecular formula C12H28N2O and a molecular weight of 216.37 g/mol. Its IUPAC name is 2-[[2-(tert-butylamino)-2-methylpropyl]amino]-2-methylpropan-1-ol.

Molecular Properties

Compound Name2-[[2-(tert-butylamino)-2-methylpropyl]amino]-2-methylpropan-1-ol
PubChem CID58721712
Molecular FormulaC12H28N2O
Molecular Weight216.37 g/mol
Exact Mass216.22
IUPAC Name2-[[2-(tert-butylamino)-2-methylpropyl]amino]-2-methylpropan-1-ol
SMILESCC(C)(C)NC(C)(C)CNC(C)(C)CO
InChIInChI=1S/C12H28N2O/c1-10(2,3)14-11(4,5)8-13-12(6,7)9-15/h13-15H,8-9H2,1-7H3
InChIKeyORLISHRWDLMTJH-UHFFFAOYSA-N
XLogP1.51
TPSA44.29 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.37
LogP ≤ 51.51
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[2-amino-3-(tert-butylamino)-2-methylpropyl]amino]-2-methylpropan-1-ol
CID 134891098
2-[[(1-hydroxy-2-methylpropan-2-yl)amino]methylamino]-2-methylpropan-1-ol;methane
CID 158688440
2-(ethylamino)-2-methylpropan-1-ol
CID 15105174
2-(2,2-dimethylpentylamino)-2-methylpropan-1-ol
CID 115133723
2-hydroxy-3-[(1-hydroxy-2-methylpropan-2-yl)amino]-2-methylpropanoic acid
CID 104643937
2,2-difluoro-3-[(1-hydroxy-2-methylpropan-2-yl)amino]propanoic acid
CID 165464166
2-(tert-butylamino)-2-methylpropane-1,3-diol
CID 58959508
2-methyl-2-[2-(methylamino)ethylamino]propan-1-ol
CID 132887947
2-(tert-butylamino)propane-1,2,3-triol
CID 166024748
2-[(tert-butylamino)methyl]-2-ethylbutan-1-ol
CID 81411478
2-[[2-(4-fluorophenyl)-2-methylpropyl]amino]-2-methylpropan-1-ol
CID 115133734
2-[(2,2-difluoro-2-phenylethyl)amino]-2-methylpropan-1-ol
CID 116788835

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(tert-butylamino)-2-methylpropyl]amino]-2-methylpropan-1-ol?
The IUPAC name of 2-[[2-(tert-butylamino)-2-methylpropyl]amino]-2-methylpropan-1-ol (CID 58721712) is 2-[[2-(tert-butylamino)-2-methylpropyl]amino]-2-methylpropan-1-ol.
What is the SMILES notation for 2-[[2-(tert-butylamino)-2-methylpropyl]amino]-2-methylpropan-1-ol?
The canonical SMILES for 2-[[2-(tert-butylamino)-2-methylpropyl]amino]-2-methylpropan-1-ol is CC(C)(C)NC(C)(C)CNC(C)(C)CO.
What is the InChIKey of 2-[[2-(tert-butylamino)-2-methylpropyl]amino]-2-methylpropan-1-ol?
The InChIKey is ORLISHRWDLMTJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H28N2O/c1-10(2,3)14-11(4,5)8-13-12(6,7)9-15/h13-15H,8-9H2,1-7H3.
What are the key properties of 2-[[2-(tert-butylamino)-2-methylpropyl]amino]-2-methylpropan-1-ol?
2-[[2-(tert-butylamino)-2-methylpropyl]amino]-2-methylpropan-1-ol has a molecular weight of 216.37 g/mol, XLogP of 1.51, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(tert-butylamino)-2-methylpropyl]amino]-2-methylpropan-1-ol is sourced from PubChem (CID 58721712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).