4-(3-methylimidazo[4,5-c]pyridin-2-yl)-1,2,3,4-tetrahydroquinoline

C16H16N4 — CID 114793439

IUPAC4-(3-methylimidazo[4,5-c]pyridin-2-yl)-1,2,3,4-tetrahydroquinoline
SMILESCn1c(C2CCNc3ccccc32)nc2ccncc21
InChIInChI=1S/C16H16N4/c1-20-15-10-17-8-7-14(15)19-16(20)12-6-9-18-13-5-3-2-4-11(12)13/h2-5,7-8,10,12,18H,6,9H2,1H3
InChIKeyOSSFFOQBQWXXIL-UHFFFAOYSA-N
MW264.33 g/mol
LogP2.92
Rot. Bonds1

About 4-(3-methylimidazo[4,5-c]pyridin-2-yl)-1,2,3,4-tetrahydroquinoline

4-(3-methylimidazo[4,5-c]pyridin-2-yl)-1,2,3,4-tetrahydroquinoline (PubChem CID 114793439) has the molecular formula C16H16N4 and a molecular weight of 264.33 g/mol. Its IUPAC name is 4-(3-methylimidazo[4,5-c]pyridin-2-yl)-1,2,3,4-tetrahydroquinoline.

Molecular Properties

Compound Name4-(3-methylimidazo[4,5-c]pyridin-2-yl)-1,2,3,4-tetrahydroquinoline
PubChem CID114793439
Molecular FormulaC16H16N4
Molecular Weight264.33 g/mol
Exact Mass264.14
IUPAC Name4-(3-methylimidazo[4,5-c]pyridin-2-yl)-1,2,3,4-tetrahydroquinoline
SMILESCn1c(C2CCNc3ccccc32)nc2ccncc21
InChIInChI=1S/C16H16N4/c1-20-15-10-17-8-7-14(15)19-16(20)12-6-9-18-13-5-3-2-4-11(12)13/h2-5,7-8,10,12,18H,6,9H2,1H3
InChIKeyOSSFFOQBQWXXIL-UHFFFAOYSA-N
XLogP2.92
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(3-methylimidazo[4,5-c]pyridin-2-yl)-1,2,3,4-tetrahydroquinoline?
The IUPAC name of 4-(3-methylimidazo[4,5-c]pyridin-2-yl)-1,2,3,4-tetrahydroquinoline (CID 114793439) is 4-(3-methylimidazo[4,5-c]pyridin-2-yl)-1,2,3,4-tetrahydroquinoline.
What is the SMILES notation for 4-(3-methylimidazo[4,5-c]pyridin-2-yl)-1,2,3,4-tetrahydroquinoline?
The canonical SMILES for 4-(3-methylimidazo[4,5-c]pyridin-2-yl)-1,2,3,4-tetrahydroquinoline is Cn1c(C2CCNc3ccccc32)nc2ccncc21.
What is the InChIKey of 4-(3-methylimidazo[4,5-c]pyridin-2-yl)-1,2,3,4-tetrahydroquinoline?
The InChIKey is OSSFFOQBQWXXIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N4/c1-20-15-10-17-8-7-14(15)19-16(20)12-6-9-18-13-5-3-2-4-11(12)13/h2-5,7-8,10,12,18H,6,9H2,1H3.
What are the key properties of 4-(3-methylimidazo[4,5-c]pyridin-2-yl)-1,2,3,4-tetrahydroquinoline?
4-(3-methylimidazo[4,5-c]pyridin-2-yl)-1,2,3,4-tetrahydroquinoline has a molecular weight of 264.33 g/mol, XLogP of 2.92, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-methylimidazo[4,5-c]pyridin-2-yl)-1,2,3,4-tetrahydroquinoline is sourced from PubChem (CID 114793439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).