1-[methyl-[[6-(methylamino)-3-pyridinyl]methyl]amino]propan-2-ol

C11H19N3O — CID 62337350

IUPAC1-[methyl-[[6-(methylamino)-3-pyridinyl]methyl]amino]propan-2-ol
SMILESCNc1ccc(CN(C)CC(C)O)cn1
InChIInChI=1S/C11H19N3O/c1-9(15)7-14(3)8-10-4-5-11(12-2)13-6-10/h4-6,9,15H,7-8H2,1-3H3,(H,12,13)
InChIKeyZBLUXQYRPRYNFX-UHFFFAOYSA-N
MW209.29 g/mol
LogP0.94
Rot. Bonds5

About 1-[methyl-[[6-(methylamino)-3-pyridinyl]methyl]amino]propan-2-ol

1-[methyl-[[6-(methylamino)-3-pyridinyl]methyl]amino]propan-2-ol (PubChem CID 62337350) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is 1-[methyl-[[6-(methylamino)-3-pyridinyl]methyl]amino]propan-2-ol.

Molecular Properties

Compound Name1-[methyl-[[6-(methylamino)-3-pyridinyl]methyl]amino]propan-2-ol
PubChem CID62337350
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name1-[methyl-[[6-(methylamino)-3-pyridinyl]methyl]amino]propan-2-ol
SMILESCNc1ccc(CN(C)CC(C)O)cn1
InChIInChI=1S/C11H19N3O/c1-9(15)7-14(3)8-10-4-5-11(12-2)13-6-10/h4-6,9,15H,7-8H2,1-3H3,(H,12,13)
InChIKeyZBLUXQYRPRYNFX-UHFFFAOYSA-N
XLogP0.94
TPSA48.39 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 50.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[methyl-[[6-(methylamino)-3-pyridinyl]methyl]amino]propan-2-ol?
The IUPAC name of 1-[methyl-[[6-(methylamino)-3-pyridinyl]methyl]amino]propan-2-ol (CID 62337350) is 1-[methyl-[[6-(methylamino)-3-pyridinyl]methyl]amino]propan-2-ol.
What is the SMILES notation for 1-[methyl-[[6-(methylamino)-3-pyridinyl]methyl]amino]propan-2-ol?
The canonical SMILES for 1-[methyl-[[6-(methylamino)-3-pyridinyl]methyl]amino]propan-2-ol is CNc1ccc(CN(C)CC(C)O)cn1.
What is the InChIKey of 1-[methyl-[[6-(methylamino)-3-pyridinyl]methyl]amino]propan-2-ol?
The InChIKey is ZBLUXQYRPRYNFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-9(15)7-14(3)8-10-4-5-11(12-2)13-6-10/h4-6,9,15H,7-8H2,1-3H3,(H,12,13).
What are the key properties of 1-[methyl-[[6-(methylamino)-3-pyridinyl]methyl]amino]propan-2-ol?
1-[methyl-[[6-(methylamino)-3-pyridinyl]methyl]amino]propan-2-ol has a molecular weight of 209.29 g/mol, XLogP of 0.94, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[methyl-[[6-(methylamino)-3-pyridinyl]methyl]amino]propan-2-ol is sourced from PubChem (CID 62337350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).