2-amino-1-(3-propan-2-ylimidazo[4,5-b]pyridin-7-yl)propan-1-ol

C12H18N4O — CID 84697742

IUPAC2-amino-1-(3-propan-2-ylimidazo[4,5-b]pyridin-7-yl)propan-1-ol
SMILESCC(N)C(O)c1ccnc2c1ncn2C(C)C
InChIInChI=1S/C12H18N4O/c1-7(2)16-6-15-10-9(11(17)8(3)13)4-5-14-12(10)16/h4-8,11,17H,13H2,1-3H3
InChIKeyYRSITTCHLVDKBS-UHFFFAOYSA-N
MW234.30 g/mol
LogP1.39
Rot. Bonds3

About 2-amino-1-(3-propan-2-ylimidazo[4,5-b]pyridin-7-yl)propan-1-ol

2-amino-1-(3-propan-2-ylimidazo[4,5-b]pyridin-7-yl)propan-1-ol (PubChem CID 84697742) has the molecular formula C12H18N4O and a molecular weight of 234.30 g/mol. Its IUPAC name is 2-amino-1-(3-propan-2-ylimidazo[4,5-b]pyridin-7-yl)propan-1-ol.

Molecular Properties

Compound Name2-amino-1-(3-propan-2-ylimidazo[4,5-b]pyridin-7-yl)propan-1-ol
PubChem CID84697742
Molecular FormulaC12H18N4O
Molecular Weight234.30 g/mol
Exact Mass234.15
IUPAC Name2-amino-1-(3-propan-2-ylimidazo[4,5-b]pyridin-7-yl)propan-1-ol
SMILESCC(N)C(O)c1ccnc2c1ncn2C(C)C
InChIInChI=1S/C12H18N4O/c1-7(2)16-6-15-10-9(11(17)8(3)13)4-5-14-12(10)16/h4-8,11,17H,13H2,1-3H3
InChIKeyYRSITTCHLVDKBS-UHFFFAOYSA-N
XLogP1.39
TPSA76.96 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 51.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-amino-1-(3-propan-2-ylimidazo[4,5-b]pyridin-7-yl)propan-1-ol?
The IUPAC name of 2-amino-1-(3-propan-2-ylimidazo[4,5-b]pyridin-7-yl)propan-1-ol (CID 84697742) is 2-amino-1-(3-propan-2-ylimidazo[4,5-b]pyridin-7-yl)propan-1-ol.
What is the SMILES notation for 2-amino-1-(3-propan-2-ylimidazo[4,5-b]pyridin-7-yl)propan-1-ol?
The canonical SMILES for 2-amino-1-(3-propan-2-ylimidazo[4,5-b]pyridin-7-yl)propan-1-ol is CC(N)C(O)c1ccnc2c1ncn2C(C)C.
What is the InChIKey of 2-amino-1-(3-propan-2-ylimidazo[4,5-b]pyridin-7-yl)propan-1-ol?
The InChIKey is YRSITTCHLVDKBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O/c1-7(2)16-6-15-10-9(11(17)8(3)13)4-5-14-12(10)16/h4-8,11,17H,13H2,1-3H3.
What are the key properties of 2-amino-1-(3-propan-2-ylimidazo[4,5-b]pyridin-7-yl)propan-1-ol?
2-amino-1-(3-propan-2-ylimidazo[4,5-b]pyridin-7-yl)propan-1-ol has a molecular weight of 234.30 g/mol, XLogP of 1.39, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-(3-propan-2-ylimidazo[4,5-b]pyridin-7-yl)propan-1-ol is sourced from PubChem (CID 84697742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).