2-methoxy-3-[(2R)-pyrrolidin-2-yl]quinoline

C14H16N2O — CID 131869108

IUPAC2-methoxy-3-[(2R)-pyrrolidin-2-yl]quinoline
SMILESCOc1nc2ccccc2cc1[C@H]1CCCN1
InChIInChI=1S/C14H16N2O/c1-17-14-11(13-7-4-8-15-13)9-10-5-2-3-6-12(10)16-14/h2-3,5-6,9,13,15H,4,7-8H2,1H3/t13-/m1/s1
InChIKeyFKCYTELUZGGGIT-CYBMUJFWSA-N
MW228.30 g/mol
LogP2.67
Rot. Bonds2

About 2-methoxy-3-[(2R)-pyrrolidin-2-yl]quinoline

2-methoxy-3-[(2R)-pyrrolidin-2-yl]quinoline (PubChem CID 131869108) has the molecular formula C14H16N2O and a molecular weight of 228.30 g/mol. Its IUPAC name is 2-methoxy-3-[(2R)-pyrrolidin-2-yl]quinoline.

Molecular Properties

Compound Name2-methoxy-3-[(2R)-pyrrolidin-2-yl]quinoline
PubChem CID131869108
Molecular FormulaC14H16N2O
Molecular Weight228.30 g/mol
Exact Mass228.13
IUPAC Name2-methoxy-3-[(2R)-pyrrolidin-2-yl]quinoline
SMILESCOc1nc2ccccc2cc1[C@H]1CCCN1
InChIInChI=1S/C14H16N2O/c1-17-14-11(13-7-4-8-15-13)9-10-5-2-3-6-12(10)16-14/h2-3,5-6,9,13,15H,4,7-8H2,1H3/t13-/m1/s1
InChIKeyFKCYTELUZGGGIT-CYBMUJFWSA-N
XLogP2.67
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.30
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-3-[(2R)-pyrrolidin-2-yl]quinoline?
The IUPAC name of 2-methoxy-3-[(2R)-pyrrolidin-2-yl]quinoline (CID 131869108) is 2-methoxy-3-[(2R)-pyrrolidin-2-yl]quinoline.
What is the SMILES notation for 2-methoxy-3-[(2R)-pyrrolidin-2-yl]quinoline?
The canonical SMILES for 2-methoxy-3-[(2R)-pyrrolidin-2-yl]quinoline is COc1nc2ccccc2cc1[C@H]1CCCN1.
What is the InChIKey of 2-methoxy-3-[(2R)-pyrrolidin-2-yl]quinoline?
The InChIKey is FKCYTELUZGGGIT-CYBMUJFWSA-N. The full InChI is InChI=1S/C14H16N2O/c1-17-14-11(13-7-4-8-15-13)9-10-5-2-3-6-12(10)16-14/h2-3,5-6,9,13,15H,4,7-8H2,1H3/t13-/m1/s1.
What are the key properties of 2-methoxy-3-[(2R)-pyrrolidin-2-yl]quinoline?
2-methoxy-3-[(2R)-pyrrolidin-2-yl]quinoline has a molecular weight of 228.30 g/mol, XLogP of 2.67, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-3-[(2R)-pyrrolidin-2-yl]quinoline is sourced from PubChem (CID 131869108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).