6-methoxy-4-(3-piperidin-3-ylpropyl)quinoline

C18H24N2O — CID 12799878

IUPAC6-methoxy-4-(3-piperidin-3-ylpropyl)quinoline
SMILESCOc1ccc2nccc(CCCC3CCCNC3)c2c1
InChIInChI=1S/C18H24N2O/c1-21-16-7-8-18-17(12-16)15(9-11-20-18)6-2-4-14-5-3-10-19-13-14/h7-9,11-12,14,19H,2-6,10,13H2,1H3
InChIKeyFZCMQWDMUOSOLN-UHFFFAOYSA-N
MW284.40 g/mol
LogP3.57
Rot. Bonds5

About 6-methoxy-4-(3-piperidin-3-ylpropyl)quinoline

6-methoxy-4-(3-piperidin-3-ylpropyl)quinoline (PubChem CID 12799878) has the molecular formula C18H24N2O and a molecular weight of 284.40 g/mol. Its IUPAC name is 6-methoxy-4-(3-piperidin-3-ylpropyl)quinoline.

Molecular Properties

Compound Name6-methoxy-4-(3-piperidin-3-ylpropyl)quinoline
PubChem CID12799878
Molecular FormulaC18H24N2O
Molecular Weight284.40 g/mol
Exact Mass284.19
IUPAC Name6-methoxy-4-(3-piperidin-3-ylpropyl)quinoline
SMILESCOc1ccc2nccc(CCCC3CCCNC3)c2c1
InChIInChI=1S/C18H24N2O/c1-21-16-7-8-18-17(12-16)15(9-11-20-18)6-2-4-14-5-3-10-19-13-14/h7-9,11-12,14,19H,2-6,10,13H2,1H3
InChIKeyFZCMQWDMUOSOLN-UHFFFAOYSA-N
XLogP3.57
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-methoxy-4-(3-piperidin-3-ylpropyl)quinoline?
The IUPAC name of 6-methoxy-4-(3-piperidin-3-ylpropyl)quinoline (CID 12799878) is 6-methoxy-4-(3-piperidin-3-ylpropyl)quinoline.
What is the SMILES notation for 6-methoxy-4-(3-piperidin-3-ylpropyl)quinoline?
The canonical SMILES for 6-methoxy-4-(3-piperidin-3-ylpropyl)quinoline is COc1ccc2nccc(CCCC3CCCNC3)c2c1.
What is the InChIKey of 6-methoxy-4-(3-piperidin-3-ylpropyl)quinoline?
The InChIKey is FZCMQWDMUOSOLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O/c1-21-16-7-8-18-17(12-16)15(9-11-20-18)6-2-4-14-5-3-10-19-13-14/h7-9,11-12,14,19H,2-6,10,13H2,1H3.
What are the key properties of 6-methoxy-4-(3-piperidin-3-ylpropyl)quinoline?
6-methoxy-4-(3-piperidin-3-ylpropyl)quinoline has a molecular weight of 284.40 g/mol, XLogP of 3.57, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-4-(3-piperidin-3-ylpropyl)quinoline is sourced from PubChem (CID 12799878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).