4-(2-ethylimidazol-1-yl)-8-methoxy-2-methylquinoline

C16H17N3O — CID 110435976

IUPAC4-(2-ethylimidazol-1-yl)-8-methoxy-2-methylquinoline
SMILESCCc1nccn1-c1cc(C)nc2c(OC)cccc12
InChIInChI=1S/C16H17N3O/c1-4-15-17-8-9-19(15)13-10-11(2)18-16-12(13)6-5-7-14(16)20-3/h5-10H,4H2,1-3H3
InChIKeyVVISVJLTLOEDBS-UHFFFAOYSA-N
MW267.33 g/mol
LogP3.30
Rot. Bonds3

About 4-(2-ethylimidazol-1-yl)-8-methoxy-2-methylquinoline

4-(2-ethylimidazol-1-yl)-8-methoxy-2-methylquinoline (PubChem CID 110435976) has the molecular formula C16H17N3O and a molecular weight of 267.33 g/mol. Its IUPAC name is 4-(2-ethylimidazol-1-yl)-8-methoxy-2-methylquinoline.

Molecular Properties

Compound Name4-(2-ethylimidazol-1-yl)-8-methoxy-2-methylquinoline
PubChem CID110435976
Molecular FormulaC16H17N3O
Molecular Weight267.33 g/mol
Exact Mass267.14
IUPAC Name4-(2-ethylimidazol-1-yl)-8-methoxy-2-methylquinoline
SMILESCCc1nccn1-c1cc(C)nc2c(OC)cccc12
InChIInChI=1S/C16H17N3O/c1-4-15-17-8-9-19(15)13-10-11(2)18-16-12(13)6-5-7-14(16)20-3/h5-10H,4H2,1-3H3
InChIKeyVVISVJLTLOEDBS-UHFFFAOYSA-N
XLogP3.30
TPSA39.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 53.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

6-bromo-4-(2-ethylimidazol-1-yl)-2-methylquinoline
CID 110436010
8-methoxy-2-methyl-4-[4-(pyrazol-1-ylmethyl)piperidin-1-yl]quinoline
CID 133388481
4-[3-(ethoxymethyl)pyrrolidin-1-yl]-8-methoxy-2-methylquinoline
CID 133368592
1-(8-methoxy-2-methylquinolin-4-yl)-N-methylmethanamine
CID 82449649
N-(2-ethoxyphenyl)-8-methoxy-2-methylquinolin-4-amine
CID 798265
5-[4-(8-methoxy-2-methylquinolin-4-yl)-1,4-diazepan-1-yl]-3-methyl-1,2,4-thiadiazole
CID 133368334
2-ethoxy-8-methoxy-4-methylquinoline
CID 70328444
N-(2-ethylphenyl)-8-methoxy-2-methylquinolin-4-amine;dihydrochloride
CID 45125627
N-(2-ethoxyethyl)-8-methoxy-N,2-dimethylquinolin-4-amine
CID 133445379
4-(2-ethylimidazol-1-yl)-2,6-dimethylpyrimidine
CID 55238460
N-[(8-methoxy-2-methylquinolin-4-yl)methyl]butan-2-amine
CID 82449656
8-methoxy-N-(4-methoxy-2,2-dimethylbutyl)-2-methylquinolin-4-amine
CID 133459634

Frequently Asked Questions

What is the IUPAC name of 4-(2-ethylimidazol-1-yl)-8-methoxy-2-methylquinoline?
The IUPAC name of 4-(2-ethylimidazol-1-yl)-8-methoxy-2-methylquinoline (CID 110435976) is 4-(2-ethylimidazol-1-yl)-8-methoxy-2-methylquinoline.
What is the SMILES notation for 4-(2-ethylimidazol-1-yl)-8-methoxy-2-methylquinoline?
The canonical SMILES for 4-(2-ethylimidazol-1-yl)-8-methoxy-2-methylquinoline is CCc1nccn1-c1cc(C)nc2c(OC)cccc12.
What is the InChIKey of 4-(2-ethylimidazol-1-yl)-8-methoxy-2-methylquinoline?
The InChIKey is VVISVJLTLOEDBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O/c1-4-15-17-8-9-19(15)13-10-11(2)18-16-12(13)6-5-7-14(16)20-3/h5-10H,4H2,1-3H3.
What are the key properties of 4-(2-ethylimidazol-1-yl)-8-methoxy-2-methylquinoline?
4-(2-ethylimidazol-1-yl)-8-methoxy-2-methylquinoline has a molecular weight of 267.33 g/mol, XLogP of 3.30, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-ethylimidazol-1-yl)-8-methoxy-2-methylquinoline is sourced from PubChem (CID 110435976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).