7-methyl-2-(1,2,3,4-tetrahydronaphthalen-1-yl)-1H-imidazo[4,5-b]pyridine

C17H17N3 — CID 63723162

IUPAC7-methyl-2-(1,2,3,4-tetrahydronaphthalen-1-yl)-1H-imidazo[4,5-b]pyridine
SMILESCc1ccnc2nc(C3CCCc4ccccc43)[nH]c12
InChIInChI=1S/C17H17N3/c1-11-9-10-18-17-15(11)19-16(20-17)14-8-4-6-12-5-2-3-7-13(12)14/h2-3,5,7,9-10,14H,4,6,8H2,1H3,(H,18,19,20)
InChIKeyVMHSNVJIVIRKCZ-UHFFFAOYSA-N
MW263.34 g/mol
LogP3.73
Rot. Bonds1

About 7-methyl-2-(1,2,3,4-tetrahydronaphthalen-1-yl)-1H-imidazo[4,5-b]pyridine

7-methyl-2-(1,2,3,4-tetrahydronaphthalen-1-yl)-1H-imidazo[4,5-b]pyridine (PubChem CID 63723162) has the molecular formula C17H17N3 and a molecular weight of 263.34 g/mol. Its IUPAC name is 7-methyl-2-(1,2,3,4-tetrahydronaphthalen-1-yl)-1H-imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name7-methyl-2-(1,2,3,4-tetrahydronaphthalen-1-yl)-1H-imidazo[4,5-b]pyridine
PubChem CID63723162
Molecular FormulaC17H17N3
Molecular Weight263.34 g/mol
Exact Mass263.14
IUPAC Name7-methyl-2-(1,2,3,4-tetrahydronaphthalen-1-yl)-1H-imidazo[4,5-b]pyridine
SMILESCc1ccnc2nc(C3CCCc4ccccc43)[nH]c12
InChIInChI=1S/C17H17N3/c1-11-9-10-18-17-15(11)19-16(20-17)14-8-4-6-12-5-2-3-7-13(12)14/h2-3,5,7,9-10,14H,4,6,8H2,1H3,(H,18,19,20)
InChIKeyVMHSNVJIVIRKCZ-UHFFFAOYSA-N
XLogP3.73
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-methyl-2-(1,2,3,4-tetrahydronaphthalen-1-yl)-1H-imidazo[4,5-b]pyridine?
The IUPAC name of 7-methyl-2-(1,2,3,4-tetrahydronaphthalen-1-yl)-1H-imidazo[4,5-b]pyridine (CID 63723162) is 7-methyl-2-(1,2,3,4-tetrahydronaphthalen-1-yl)-1H-imidazo[4,5-b]pyridine.
What is the SMILES notation for 7-methyl-2-(1,2,3,4-tetrahydronaphthalen-1-yl)-1H-imidazo[4,5-b]pyridine?
The canonical SMILES for 7-methyl-2-(1,2,3,4-tetrahydronaphthalen-1-yl)-1H-imidazo[4,5-b]pyridine is Cc1ccnc2nc(C3CCCc4ccccc43)[nH]c12.
What is the InChIKey of 7-methyl-2-(1,2,3,4-tetrahydronaphthalen-1-yl)-1H-imidazo[4,5-b]pyridine?
The InChIKey is VMHSNVJIVIRKCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3/c1-11-9-10-18-17-15(11)19-16(20-17)14-8-4-6-12-5-2-3-7-13(12)14/h2-3,5,7,9-10,14H,4,6,8H2,1H3,(H,18,19,20).
What are the key properties of 7-methyl-2-(1,2,3,4-tetrahydronaphthalen-1-yl)-1H-imidazo[4,5-b]pyridine?
7-methyl-2-(1,2,3,4-tetrahydronaphthalen-1-yl)-1H-imidazo[4,5-b]pyridine has a molecular weight of 263.34 g/mol, XLogP of 3.73, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-2-(1,2,3,4-tetrahydronaphthalen-1-yl)-1H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 63723162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).