3-(3,4-dihydro-2H-chromen-4-yl)imidazo[4,5-b]pyridin-2-amine

C15H14N4O — CID 79273247

IUPAC3-(3,4-dihydro-2H-chromen-4-yl)imidazo[4,5-b]pyridin-2-amine
SMILESNc1nc2cccnc2n1C1CCOc2ccccc21
InChIInChI=1S/C15H14N4O/c16-15-18-11-5-3-8-17-14(11)19(15)12-7-9-20-13-6-2-1-4-10(12)13/h1-6,8,12H,7,9H2,(H2,16,18)
InChIKeyLTBLGTFGASQMRX-UHFFFAOYSA-N
MW266.30 g/mol
LogP2.39
Rot. Bonds1

About 3-(3,4-dihydro-2H-chromen-4-yl)imidazo[4,5-b]pyridin-2-amine

3-(3,4-dihydro-2H-chromen-4-yl)imidazo[4,5-b]pyridin-2-amine (PubChem CID 79273247) has the molecular formula C15H14N4O and a molecular weight of 266.30 g/mol. Its IUPAC name is 3-(3,4-dihydro-2H-chromen-4-yl)imidazo[4,5-b]pyridin-2-amine.

Molecular Properties

Compound Name3-(3,4-dihydro-2H-chromen-4-yl)imidazo[4,5-b]pyridin-2-amine
PubChem CID79273247
Molecular FormulaC15H14N4O
Molecular Weight266.30 g/mol
Exact Mass266.12
IUPAC Name3-(3,4-dihydro-2H-chromen-4-yl)imidazo[4,5-b]pyridin-2-amine
SMILESNc1nc2cccnc2n1C1CCOc2ccccc21
InChIInChI=1S/C15H14N4O/c16-15-18-11-5-3-8-17-14(11)19(15)12-7-9-20-13-6-2-1-4-10(12)13/h1-6,8,12H,7,9H2,(H2,16,18)
InChIKeyLTBLGTFGASQMRX-UHFFFAOYSA-N
XLogP2.39
TPSA65.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-(3,4-dihydro-2H-chromen-4-yl)imidazo[4,5-b]pyridin-2-amine?
The IUPAC name of 3-(3,4-dihydro-2H-chromen-4-yl)imidazo[4,5-b]pyridin-2-amine (CID 79273247) is 3-(3,4-dihydro-2H-chromen-4-yl)imidazo[4,5-b]pyridin-2-amine.
What is the SMILES notation for 3-(3,4-dihydro-2H-chromen-4-yl)imidazo[4,5-b]pyridin-2-amine?
The canonical SMILES for 3-(3,4-dihydro-2H-chromen-4-yl)imidazo[4,5-b]pyridin-2-amine is Nc1nc2cccnc2n1C1CCOc2ccccc21.
What is the InChIKey of 3-(3,4-dihydro-2H-chromen-4-yl)imidazo[4,5-b]pyridin-2-amine?
The InChIKey is LTBLGTFGASQMRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O/c16-15-18-11-5-3-8-17-14(11)19(15)12-7-9-20-13-6-2-1-4-10(12)13/h1-6,8,12H,7,9H2,(H2,16,18).
What are the key properties of 3-(3,4-dihydro-2H-chromen-4-yl)imidazo[4,5-b]pyridin-2-amine?
3-(3,4-dihydro-2H-chromen-4-yl)imidazo[4,5-b]pyridin-2-amine has a molecular weight of 266.30 g/mol, XLogP of 2.39, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,4-dihydro-2H-chromen-4-yl)imidazo[4,5-b]pyridin-2-amine is sourced from PubChem (CID 79273247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).