8-methyl-5-(3-methyl-2-pyridinyl)-5,6,7,8-tetrahydroquinoline

C16H18N2 — CID 145383942

IUPAC8-methyl-5-(3-methyl-2-pyridinyl)-5,6,7,8-tetrahydroquinoline
SMILESCc1cccnc1C1CCC(C)c2ncccc21
InChIInChI=1S/C16H18N2/c1-11-5-3-9-17-15(11)14-8-7-12(2)16-13(14)6-4-10-18-16/h3-6,9-10,12,14H,7-8H2,1-2H3
InChIKeyQVAZNNOVDCHADJ-UHFFFAOYSA-N
MW238.33 g/mol
LogP3.81
Rot. Bonds1

About 8-methyl-5-(3-methyl-2-pyridinyl)-5,6,7,8-tetrahydroquinoline

8-methyl-5-(3-methyl-2-pyridinyl)-5,6,7,8-tetrahydroquinoline (PubChem CID 145383942) has the molecular formula C16H18N2 and a molecular weight of 238.33 g/mol. Its IUPAC name is 8-methyl-5-(3-methyl-2-pyridinyl)-5,6,7,8-tetrahydroquinoline.

Molecular Properties

Compound Name8-methyl-5-(3-methyl-2-pyridinyl)-5,6,7,8-tetrahydroquinoline
PubChem CID145383942
Molecular FormulaC16H18N2
Molecular Weight238.33 g/mol
Exact Mass238.15
IUPAC Name8-methyl-5-(3-methyl-2-pyridinyl)-5,6,7,8-tetrahydroquinoline
SMILESCc1cccnc1C1CCC(C)c2ncccc21
InChIInChI=1S/C16H18N2/c1-11-5-3-9-17-15(11)14-8-7-12(2)16-13(14)6-4-10-18-16/h3-6,9-10,12,14H,7-8H2,1-2H3
InChIKeyQVAZNNOVDCHADJ-UHFFFAOYSA-N
XLogP3.81
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 53.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8-methyl-5-(3-methyl-2-pyridinyl)-5,6,7,8-tetrahydroquinoline?
The IUPAC name of 8-methyl-5-(3-methyl-2-pyridinyl)-5,6,7,8-tetrahydroquinoline (CID 145383942) is 8-methyl-5-(3-methyl-2-pyridinyl)-5,6,7,8-tetrahydroquinoline.
What is the SMILES notation for 8-methyl-5-(3-methyl-2-pyridinyl)-5,6,7,8-tetrahydroquinoline?
The canonical SMILES for 8-methyl-5-(3-methyl-2-pyridinyl)-5,6,7,8-tetrahydroquinoline is Cc1cccnc1C1CCC(C)c2ncccc21.
What is the InChIKey of 8-methyl-5-(3-methyl-2-pyridinyl)-5,6,7,8-tetrahydroquinoline?
The InChIKey is QVAZNNOVDCHADJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2/c1-11-5-3-9-17-15(11)14-8-7-12(2)16-13(14)6-4-10-18-16/h3-6,9-10,12,14H,7-8H2,1-2H3.
What are the key properties of 8-methyl-5-(3-methyl-2-pyridinyl)-5,6,7,8-tetrahydroquinoline?
8-methyl-5-(3-methyl-2-pyridinyl)-5,6,7,8-tetrahydroquinoline has a molecular weight of 238.33 g/mol, XLogP of 3.81, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-5-(3-methyl-2-pyridinyl)-5,6,7,8-tetrahydroquinoline is sourced from PubChem (CID 145383942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).