5-methyl-3-(1-phenylpropan-2-yl)imidazo[4,5-b]pyridin-2-amine

C16H18N4 — CID 81135372

IUPAC5-methyl-3-(1-phenylpropan-2-yl)imidazo[4,5-b]pyridin-2-amine
SMILESCc1ccc2nc(N)n(C(C)Cc3ccccc3)c2n1
InChIInChI=1S/C16H18N4/c1-11-8-9-14-15(18-11)20(16(17)19-14)12(2)10-13-6-4-3-5-7-13/h3-9,12H,10H2,1-2H3,(H2,17,19)
InChIKeyQPTKVNYLXBSMLU-UHFFFAOYSA-N
MW266.35 g/mol
LogP3.13
Rot. Bonds3

About 5-methyl-3-(1-phenylpropan-2-yl)imidazo[4,5-b]pyridin-2-amine

5-methyl-3-(1-phenylpropan-2-yl)imidazo[4,5-b]pyridin-2-amine (PubChem CID 81135372) has the molecular formula C16H18N4 and a molecular weight of 266.35 g/mol. Its IUPAC name is 5-methyl-3-(1-phenylpropan-2-yl)imidazo[4,5-b]pyridin-2-amine.

Molecular Properties

Compound Name5-methyl-3-(1-phenylpropan-2-yl)imidazo[4,5-b]pyridin-2-amine
PubChem CID81135372
Molecular FormulaC16H18N4
Molecular Weight266.35 g/mol
Exact Mass266.15
IUPAC Name5-methyl-3-(1-phenylpropan-2-yl)imidazo[4,5-b]pyridin-2-amine
SMILESCc1ccc2nc(N)n(C(C)Cc3ccccc3)c2n1
InChIInChI=1S/C16H18N4/c1-11-8-9-14-15(18-11)20(16(17)19-14)12(2)10-13-6-4-3-5-7-13/h3-9,12H,10H2,1-2H3,(H2,17,19)
InChIKeyQPTKVNYLXBSMLU-UHFFFAOYSA-N
XLogP3.13
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.35
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-3-(1-phenylpropan-2-yl)imidazo[4,5-b]pyridin-2-amine?
The IUPAC name of 5-methyl-3-(1-phenylpropan-2-yl)imidazo[4,5-b]pyridin-2-amine (CID 81135372) is 5-methyl-3-(1-phenylpropan-2-yl)imidazo[4,5-b]pyridin-2-amine.
What is the SMILES notation for 5-methyl-3-(1-phenylpropan-2-yl)imidazo[4,5-b]pyridin-2-amine?
The canonical SMILES for 5-methyl-3-(1-phenylpropan-2-yl)imidazo[4,5-b]pyridin-2-amine is Cc1ccc2nc(N)n(C(C)Cc3ccccc3)c2n1.
What is the InChIKey of 5-methyl-3-(1-phenylpropan-2-yl)imidazo[4,5-b]pyridin-2-amine?
The InChIKey is QPTKVNYLXBSMLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4/c1-11-8-9-14-15(18-11)20(16(17)19-14)12(2)10-13-6-4-3-5-7-13/h3-9,12H,10H2,1-2H3,(H2,17,19).
What are the key properties of 5-methyl-3-(1-phenylpropan-2-yl)imidazo[4,5-b]pyridin-2-amine?
5-methyl-3-(1-phenylpropan-2-yl)imidazo[4,5-b]pyridin-2-amine has a molecular weight of 266.35 g/mol, XLogP of 3.13, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-3-(1-phenylpropan-2-yl)imidazo[4,5-b]pyridin-2-amine is sourced from PubChem (CID 81135372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).