6-(3-methoxyprop-2-enyl)quinoline

C13H13NO — CID 169099761

IUPAC6-(3-methoxyprop-2-enyl)quinoline
SMILESCOC=CCc1ccc2ncccc2c1
InChIInChI=1S/C13H13NO/c1-15-9-3-4-11-6-7-13-12(10-11)5-2-8-14-13/h2-3,5-10H,4H2,1H3
InChIKeyRCQBSNNOKMFNIO-UHFFFAOYSA-N
MW199.25 g/mol
LogP2.94
Rot. Bonds3

About 6-(3-methoxyprop-2-enyl)quinoline

6-(3-methoxyprop-2-enyl)quinoline (PubChem CID 169099761) has the molecular formula C13H13NO and a molecular weight of 199.25 g/mol. Its IUPAC name is 6-(3-methoxyprop-2-enyl)quinoline.

Molecular Properties

Compound Name6-(3-methoxyprop-2-enyl)quinoline
PubChem CID169099761
Molecular FormulaC13H13NO
Molecular Weight199.25 g/mol
Exact Mass199.10
IUPAC Name6-(3-methoxyprop-2-enyl)quinoline
SMILESCOC=CCc1ccc2ncccc2c1
InChIInChI=1S/C13H13NO/c1-15-9-3-4-11-6-7-13-12(10-11)5-2-8-14-13/h2-3,5-10H,4H2,1H3
InChIKeyRCQBSNNOKMFNIO-UHFFFAOYSA-N
XLogP2.94
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.25
LogP ≤ 52.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Related Compounds

N-(3-methoxyprop-2-enyl)-N-phenylquinolin-6-amine
CID 158124889
6-[(3-methoxyphenyl)methyl]quinoline
CID 172878073
6-(2-methoxyethylsulfanylmethyl)quinoline
CID 136532204
6-(2-bromoethyl)quinoline
CID 68811984
6-(2-chloroethyl)quinoline
CID 53404433
6-methylquinoline
CID 7059
ethyl(quinolin-6-ylmethyl)phosphane
CID 142150955
ethane;ethylbenzene;6-ethylquinoline
CID 143817758
methyl 4-quinolin-6-ylbutanoate
CID 116997352
6-[(2,5-dimethylphenyl)methyl]quinoline
CID 156905634
4-methoxy-N-(quinolin-6-ylmethyl)butan-2-amine
CID 62733913
iodoethane;6-methylquinoline
CID 160581758

Frequently Asked Questions

What is the IUPAC name of 6-(3-methoxyprop-2-enyl)quinoline?
The IUPAC name of 6-(3-methoxyprop-2-enyl)quinoline (CID 169099761) is 6-(3-methoxyprop-2-enyl)quinoline.
What is the SMILES notation for 6-(3-methoxyprop-2-enyl)quinoline?
The canonical SMILES for 6-(3-methoxyprop-2-enyl)quinoline is COC=CCc1ccc2ncccc2c1.
What is the InChIKey of 6-(3-methoxyprop-2-enyl)quinoline?
The InChIKey is RCQBSNNOKMFNIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13NO/c1-15-9-3-4-11-6-7-13-12(10-11)5-2-8-14-13/h2-3,5-10H,4H2,1H3.
What are the key properties of 6-(3-methoxyprop-2-enyl)quinoline?
6-(3-methoxyprop-2-enyl)quinoline has a molecular weight of 199.25 g/mol, XLogP of 2.94, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-methoxyprop-2-enyl)quinoline is sourced from PubChem (CID 169099761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).