[methyl-[[methyl(methylaminomethyl)amino]methyl]amino]methanol;bis([methyl-[[methyl(propyl)amino]methyl]amino]methanol);2-methylpropane

C24H63N7O3 — CID 158336212

IUPAC[methyl-[[methyl(methylaminomethyl)amino]methyl]amino]methanol;bis([methyl-[[methyl(propyl)amino]methyl]amino]methanol);2-methylpropane
SMILESCC(C)C.CCCN(C)CN(C)CO.CCCN(C)CN(C)CO.CNCN(C)CN(C)CO
InChIInChI=1S/2C7H18N2O.C6H17N3O.C4H10/c2*1-4-5-8(2)6-9(3)7-10;1-7-4-8(2)5-9(3)6-10;1-4(2)3/h2*10H,4-7H2,1-3H3;7,10H,4-6H2,1-3H3;4H,1-3H3
InChIKeyGQPODALCFOVFFN-UHFFFAOYSA-N
MW497.81 g/mol
LogP0.93
Rot. Bonds15

About [methyl-[[methyl(methylaminomethyl)amino]methyl]amino]methanol;bis([methyl-[[methyl(propyl)amino]methyl]amino]methanol);2-methylpropane

[methyl-[[methyl(methylaminomethyl)amino]methyl]amino]methanol;bis([methyl-[[methyl(propyl)amino]methyl]amino]methanol);2-methylpropane (PubChem CID 158336212) has the molecular formula C24H63N7O3 and a molecular weight of 497.81 g/mol. Its IUPAC name is [methyl-[[methyl(methylaminomethyl)amino]methyl]amino]methanol;bis([methyl-[[methyl(propyl)amino]methyl]amino]methanol);2-methylpropane.

Molecular Properties

Compound Name[methyl-[[methyl(methylaminomethyl)amino]methyl]amino]methanol;bis([methyl-[[methyl(propyl)amino]methyl]amino]methanol);2-methylpropane
PubChem CID158336212
Molecular FormulaC24H63N7O3
Molecular Weight497.81 g/mol
Exact Mass497.50
IUPAC Name[methyl-[[methyl(methylaminomethyl)amino]methyl]amino]methanol;bis([methyl-[[methyl(propyl)amino]methyl]amino]methanol);2-methylpropane
SMILESCC(C)C.CCCN(C)CN(C)CO.CCCN(C)CN(C)CO.CNCN(C)CN(C)CO
InChIInChI=1S/2C7H18N2O.C6H17N3O.C4H10/c2*1-4-5-8(2)6-9(3)7-10;1-7-4-8(2)5-9(3)6-10;1-4(2)3/h2*10H,4-7H2,1-3H3;7,10H,4-6H2,1-3H3;4H,1-3H3
InChIKeyGQPODALCFOVFFN-UHFFFAOYSA-N
XLogP0.93
TPSA92.16 Ų
H-Bond Donors4
H-Bond Acceptors10
Rotatable Bonds15
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500497.81
LogP ≤ 50.93
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

[2,2-Dimethylpropyl-[[2,2-dimethylpropyl-[(2,2-dimethylpropylamino)methyl]amino]methyl]amino]methanol
CID 121287948
[Ethyl-[[ethyl(ethylaminomethyl)amino]methyl]amino]methanol
CID 157430945
[Methyl-[[methyl(methylaminomethyl)amino]methyl]amino]methanol;bis([methyl-[[methyl(propyl)amino]methyl]amino]methanol);3-methylpentane
CID 158881565
1,3-Bis(2,2-dimethylpropyl)-5-methyl-1,3,5-triazinane;[2,2-dimethylpropyl-[[2,2-dimethylpropyl(methylaminomethyl)amino]methyl]amino]methanol
CID 159836604
1,3-Bis(2,2-dimethylpropyl)-5-methyl-1,3,5-triazinane;[2,2-dimethylpropyl-[[(2,2-dimethylpropylamino)methyl-methylamino]methyl]amino]methanol
CID 161641927
[Di(propan-2-yl)amino]-[[3-[[[di(propan-2-yl)amino]-hydroxymethyl]amino]-2,2-dimethylpropyl]amino]methanol
CID 134851214
[2,2-Dimethylpropyl-[[2,2-dimethylpropyl(methylaminomethyl)amino]methyl]amino]methanol
CID 159836606
[2,2-Dimethylpropyl-[[(2,2-dimethylpropylamino)methyl-methylamino]methyl]amino]methanol
CID 161641928

Frequently Asked Questions

What is the IUPAC name of [methyl-[[methyl(methylaminomethyl)amino]methyl]amino]methanol;bis([methyl-[[methyl(propyl)amino]methyl]amino]methanol);2-methylpropane?
The IUPAC name of [methyl-[[methyl(methylaminomethyl)amino]methyl]amino]methanol;bis([methyl-[[methyl(propyl)amino]methyl]amino]methanol);2-methylpropane (CID 158336212) is [methyl-[[methyl(methylaminomethyl)amino]methyl]amino]methanol;bis([methyl-[[methyl(propyl)amino]methyl]amino]methanol);2-methylpropane.
What is the SMILES notation for [methyl-[[methyl(methylaminomethyl)amino]methyl]amino]methanol;bis([methyl-[[methyl(propyl)amino]methyl]amino]methanol);2-methylpropane?
The canonical SMILES for [methyl-[[methyl(methylaminomethyl)amino]methyl]amino]methanol;bis([methyl-[[methyl(propyl)amino]methyl]amino]methanol);2-methylpropane is CC(C)C.CCCN(C)CN(C)CO.CCCN(C)CN(C)CO.CNCN(C)CN(C)CO.
What is the InChIKey of [methyl-[[methyl(methylaminomethyl)amino]methyl]amino]methanol;bis([methyl-[[methyl(propyl)amino]methyl]amino]methanol);2-methylpropane?
The InChIKey is GQPODALCFOVFFN-UHFFFAOYSA-N. The full InChI is InChI=1S/2C7H18N2O.C6H17N3O.C4H10/c2*1-4-5-8(2)6-9(3)7-10;1-7-4-8(2)5-9(3)6-10;1-4(2)3/h2*10H,4-7H2,1-3H3;7,10H,4-6H2,1-3H3;4H,1-3H3.
What are the key properties of [methyl-[[methyl(methylaminomethyl)amino]methyl]amino]methanol;bis([methyl-[[methyl(propyl)amino]methyl]amino]methanol);2-methylpropane?
[methyl-[[methyl(methylaminomethyl)amino]methyl]amino]methanol;bis([methyl-[[methyl(propyl)amino]methyl]amino]methanol);2-methylpropane has a molecular weight of 497.81 g/mol, XLogP of 0.93, 15 rotatable bonds, 4 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for [methyl-[[methyl(methylaminomethyl)amino]methyl]amino]methanol;bis([methyl-[[methyl(propyl)amino]methyl]amino]methanol);2-methylpropane is sourced from PubChem (CID 158336212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).