1-[methyl-[2-(methylamino)ethyl]amino]propan-2-ol

C7H18N2O — CID 62337944

IUPAC1-[methyl-[2-(methylamino)ethyl]amino]propan-2-ol
SMILESCNCCN(C)CC(C)O
InChIInChI=1S/C7H18N2O/c1-7(10)6-9(3)5-4-8-2/h7-8,10H,4-6H2,1-3H3
InChIKeyLEWPXAIRKFRIKU-UHFFFAOYSA-N
MW146.23 g/mol
LogP-0.48
Rot. Bonds5

About 1-[methyl-[2-(methylamino)ethyl]amino]propan-2-ol

1-[methyl-[2-(methylamino)ethyl]amino]propan-2-ol (PubChem CID 62337944) has the molecular formula C7H18N2O and a molecular weight of 146.23 g/mol. Its IUPAC name is 1-[methyl-[2-(methylamino)ethyl]amino]propan-2-ol.

Molecular Properties

Compound Name1-[methyl-[2-(methylamino)ethyl]amino]propan-2-ol
PubChem CID62337944
Molecular FormulaC7H18N2O
Molecular Weight146.23 g/mol
Exact Mass146.14
IUPAC Name1-[methyl-[2-(methylamino)ethyl]amino]propan-2-ol
SMILESCNCCN(C)CC(C)O
InChIInChI=1S/C7H18N2O/c1-7(10)6-9(3)5-4-8-2/h7-8,10H,4-6H2,1-3H3
InChIKeyLEWPXAIRKFRIKU-UHFFFAOYSA-N
XLogP-0.48
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.23
LogP ≤ 5-0.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[methyl-[2-(methylamino)ethyl]amino]propan-2-ol?
The IUPAC name of 1-[methyl-[2-(methylamino)ethyl]amino]propan-2-ol (CID 62337944) is 1-[methyl-[2-(methylamino)ethyl]amino]propan-2-ol.
What is the SMILES notation for 1-[methyl-[2-(methylamino)ethyl]amino]propan-2-ol?
The canonical SMILES for 1-[methyl-[2-(methylamino)ethyl]amino]propan-2-ol is CNCCN(C)CC(C)O.
What is the InChIKey of 1-[methyl-[2-(methylamino)ethyl]amino]propan-2-ol?
The InChIKey is LEWPXAIRKFRIKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H18N2O/c1-7(10)6-9(3)5-4-8-2/h7-8,10H,4-6H2,1-3H3.
What are the key properties of 1-[methyl-[2-(methylamino)ethyl]amino]propan-2-ol?
1-[methyl-[2-(methylamino)ethyl]amino]propan-2-ol has a molecular weight of 146.23 g/mol, XLogP of -0.48, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[methyl-[2-(methylamino)ethyl]amino]propan-2-ol is sourced from PubChem (CID 62337944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).