2-methoxy-2-(3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)ethanamine

C12H18N4O — CID 114144455

IUPAC2-methoxy-2-(3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)ethanamine
SMILESCOC(CN)c1nc2cccnc2n1C(C)C
InChIInChI=1S/C12H18N4O/c1-8(2)16-11-9(5-4-6-14-11)15-12(16)10(7-13)17-3/h4-6,8,10H,7,13H2,1-3H3
InChIKeyFZXPLCJQNVHHQF-UHFFFAOYSA-N
MW234.30 g/mol
LogP1.66
Rot. Bonds4

About 2-methoxy-2-(3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)ethanamine

2-methoxy-2-(3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)ethanamine (PubChem CID 114144455) has the molecular formula C12H18N4O and a molecular weight of 234.30 g/mol. Its IUPAC name is 2-methoxy-2-(3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)ethanamine.

Molecular Properties

Compound Name2-methoxy-2-(3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)ethanamine
PubChem CID114144455
Molecular FormulaC12H18N4O
Molecular Weight234.30 g/mol
Exact Mass234.15
IUPAC Name2-methoxy-2-(3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)ethanamine
SMILESCOC(CN)c1nc2cccnc2n1C(C)C
InChIInChI=1S/C12H18N4O/c1-8(2)16-11-9(5-4-6-14-11)15-12(16)10(7-13)17-3/h4-6,8,10H,7,13H2,1-3H3
InChIKeyFZXPLCJQNVHHQF-UHFFFAOYSA-N
XLogP1.66
TPSA65.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-2-(3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)ethanamine?
The IUPAC name of 2-methoxy-2-(3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)ethanamine (CID 114144455) is 2-methoxy-2-(3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)ethanamine.
What is the SMILES notation for 2-methoxy-2-(3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)ethanamine?
The canonical SMILES for 2-methoxy-2-(3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)ethanamine is COC(CN)c1nc2cccnc2n1C(C)C.
What is the InChIKey of 2-methoxy-2-(3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)ethanamine?
The InChIKey is FZXPLCJQNVHHQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O/c1-8(2)16-11-9(5-4-6-14-11)15-12(16)10(7-13)17-3/h4-6,8,10H,7,13H2,1-3H3.
What are the key properties of 2-methoxy-2-(3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)ethanamine?
2-methoxy-2-(3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)ethanamine has a molecular weight of 234.30 g/mol, XLogP of 1.66, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-2-(3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)ethanamine is sourced from PubChem (CID 114144455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).