7-methoxy-4-(2-methylpyrrolidin-2-yl)quinoline

C15H18N2O — CID 82664348

IUPAC7-methoxy-4-(2-methylpyrrolidin-2-yl)quinoline
SMILESCOc1ccc2c(C3(C)CCCN3)ccnc2c1
InChIInChI=1S/C15H18N2O/c1-15(7-3-8-17-15)13-6-9-16-14-10-11(18-2)4-5-12(13)14/h4-6,9-10,17H,3,7-8H2,1-2H3
InChIKeyNFLXULLZBMQCBO-UHFFFAOYSA-N
MW242.32 g/mol
LogP2.84
Rot. Bonds2

About 7-methoxy-4-(2-methylpyrrolidin-2-yl)quinoline

7-methoxy-4-(2-methylpyrrolidin-2-yl)quinoline (PubChem CID 82664348) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is 7-methoxy-4-(2-methylpyrrolidin-2-yl)quinoline.

Molecular Properties

Compound Name7-methoxy-4-(2-methylpyrrolidin-2-yl)quinoline
PubChem CID82664348
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC Name7-methoxy-4-(2-methylpyrrolidin-2-yl)quinoline
SMILESCOc1ccc2c(C3(C)CCCN3)ccnc2c1
InChIInChI=1S/C15H18N2O/c1-15(7-3-8-17-15)13-6-9-16-14-10-11(18-2)4-5-12(13)14/h4-6,9-10,17H,3,7-8H2,1-2H3
InChIKeyNFLXULLZBMQCBO-UHFFFAOYSA-N
XLogP2.84
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-methoxy-4-(2-methylpyrrolidin-2-yl)quinoline?
The IUPAC name of 7-methoxy-4-(2-methylpyrrolidin-2-yl)quinoline (CID 82664348) is 7-methoxy-4-(2-methylpyrrolidin-2-yl)quinoline.
What is the SMILES notation for 7-methoxy-4-(2-methylpyrrolidin-2-yl)quinoline?
The canonical SMILES for 7-methoxy-4-(2-methylpyrrolidin-2-yl)quinoline is COc1ccc2c(C3(C)CCCN3)ccnc2c1.
What is the InChIKey of 7-methoxy-4-(2-methylpyrrolidin-2-yl)quinoline?
The InChIKey is NFLXULLZBMQCBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-15(7-3-8-17-15)13-6-9-16-14-10-11(18-2)4-5-12(13)14/h4-6,9-10,17H,3,7-8H2,1-2H3.
What are the key properties of 7-methoxy-4-(2-methylpyrrolidin-2-yl)quinoline?
7-methoxy-4-(2-methylpyrrolidin-2-yl)quinoline has a molecular weight of 242.32 g/mol, XLogP of 2.84, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-4-(2-methylpyrrolidin-2-yl)quinoline is sourced from PubChem (CID 82664348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).