4-methoxy-2-pyrrolidin-2-ylquinoline

C14H16N2O — CID 3320463

IUPAC4-methoxy-2-pyrrolidin-2-ylquinoline
SMILESCOc1cc(C2CCCN2)nc2ccccc12
InChIInChI=1S/C14H16N2O/c1-17-14-9-13(12-7-4-8-15-12)16-11-6-3-2-5-10(11)14/h2-3,5-6,9,12,15H,4,7-8H2,1H3
InChIKeyZHANWFJKAPOVAV-UHFFFAOYSA-N
MW228.30 g/mol
LogP2.67
Rot. Bonds2

About 4-methoxy-2-pyrrolidin-2-ylquinoline

4-methoxy-2-pyrrolidin-2-ylquinoline (PubChem CID 3320463) has the molecular formula C14H16N2O and a molecular weight of 228.30 g/mol. Its IUPAC name is 4-methoxy-2-pyrrolidin-2-ylquinoline.

Molecular Properties

Compound Name4-methoxy-2-pyrrolidin-2-ylquinoline
PubChem CID3320463
Molecular FormulaC14H16N2O
Molecular Weight228.30 g/mol
Exact Mass228.13
IUPAC Name4-methoxy-2-pyrrolidin-2-ylquinoline
SMILESCOc1cc(C2CCCN2)nc2ccccc12
InChIInChI=1S/C14H16N2O/c1-17-14-9-13(12-7-4-8-15-12)16-11-6-3-2-5-10(11)14/h2-3,5-6,9,12,15H,4,7-8H2,1H3
InChIKeyZHANWFJKAPOVAV-UHFFFAOYSA-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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Related Compounds

2-cyclohex-2-en-1-yl-4-methoxyquinoline
CID 20743625
2-(2-methoxyphenyl)-4-[(2S)-pyrrolidin-2-yl]-1,3-thiazole
CID 104928786
5-(2-methoxyphenyl)-3-pyrrolidin-2-yl-1,2-oxazole
CID 46785770
7-methoxy-2-pyrrolidin-2-ylquinoline-4-carboxylic acid
CID 84641748
2-(3-methoxynaphthalen-2-yl)pyrrolidine
CID 4540361
2-pyrrolidin-2-ylbenzo[g]quinoline-4-carboxylic acid
CID 134103584
(2R)-2-(4-methoxynaphthalen-1-yl)pyrrolidine;hydrochloride
CID 171196102
2-methoxy-3-[(2R)-pyrrolidin-2-yl]quinoline
CID 131869108
(2R)-2-(2-methoxyphenyl)pyrrolidine
CID 7047810
6-methoxy-5-pyrrolidin-2-ylquinoline
CID 4000305
2-(2-methoxyphenyl)-4,6-dimethyl-5-pyrrolidin-2-ylpyrimidine
CID 115069875
2-phenyl-4-[(2R)-piperidin-2-yl]quinoline
CID 7144282

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2-pyrrolidin-2-ylquinoline?
The IUPAC name of 4-methoxy-2-pyrrolidin-2-ylquinoline (CID 3320463) is 4-methoxy-2-pyrrolidin-2-ylquinoline.
What is the SMILES notation for 4-methoxy-2-pyrrolidin-2-ylquinoline?
The canonical SMILES for 4-methoxy-2-pyrrolidin-2-ylquinoline is COc1cc(C2CCCN2)nc2ccccc12.
What is the InChIKey of 4-methoxy-2-pyrrolidin-2-ylquinoline?
The InChIKey is ZHANWFJKAPOVAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O/c1-17-14-9-13(12-7-4-8-15-12)16-11-6-3-2-5-10(11)14/h2-3,5-6,9,12,15H,4,7-8H2,1H3.
What are the key properties of 4-methoxy-2-pyrrolidin-2-ylquinoline?
4-methoxy-2-pyrrolidin-2-ylquinoline 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 4-methoxy-2-pyrrolidin-2-ylquinoline is sourced from PubChem (CID 3320463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).