6-[(E)-but-1-enyl]-4-methylquinoline

C14H15N — CID 176872163

IUPAC6-[(E)-but-1-enyl]-4-methylquinoline
SMILESCC/C=C/c1ccc2nccc(C)c2c1
InChIInChI=1S/C14H15N/c1-3-4-5-12-6-7-14-13(10-12)11(2)8-9-15-14/h4-10H,3H2,1-2H3/b5-4+
InChIKeyUHSWDZKPMPNAHS-SNAWJCMRSA-N
MW197.28 g/mol
LogP3.97
Rot. Bonds2

About 6-[(E)-but-1-enyl]-4-methylquinoline

6-[(E)-but-1-enyl]-4-methylquinoline (PubChem CID 176872163) has the molecular formula C14H15N and a molecular weight of 197.28 g/mol. Its IUPAC name is 6-[(E)-but-1-enyl]-4-methylquinoline.

Molecular Properties

Compound Name6-[(E)-but-1-enyl]-4-methylquinoline
PubChem CID176872163
Molecular FormulaC14H15N
Molecular Weight197.28 g/mol
Exact Mass197.12
IUPAC Name6-[(E)-but-1-enyl]-4-methylquinoline
SMILESCC/C=C/c1ccc2nccc(C)c2c1
InChIInChI=1S/C14H15N/c1-3-4-5-12-6-7-14-13(10-12)11(2)8-9-15-14/h4-10H,3H2,1-2H3/b5-4+
InChIKeyUHSWDZKPMPNAHS-SNAWJCMRSA-N
XLogP3.97
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 53.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-but-1-enyl-1,2-dimethylbenzene
CID 54516988
4-but-1-enyl-1,2-bis(ethenyl)benzene
CID 154450625
4-[(Z)-but-1-enyl]-2-methylpyridine;carbon dioxide
CID 157450822
2-(4-methylquinolin-6-yl)acetaldehyde
CID 83876531
4-[(E)-but-1-enyl]-1,2-dimethylbenzene;methanamine
CID 144895148
(4-methylquinolin-6-yl)methanesulfinate
CID 174719055
4-methylquinoline-7-carbaldehyde
CID 22464912
4-methyl-6-(2-methylpropoxy)quinoline
CID 82580912
N-methyl-2-(4-methylquinolin-6-yl)ethanamine
CID 83880761
1-(4-methylquinolin-6-yl)ethanol
CID 82575956
(E)-3-(3-methyl-2H-indazol-5-yl)prop-2-en-1-amine
CID 117280872
4-methylquinoline-6,7-diamine
CID 177181300

Frequently Asked Questions

What is the IUPAC name of 6-[(E)-but-1-enyl]-4-methylquinoline?
The IUPAC name of 6-[(E)-but-1-enyl]-4-methylquinoline (CID 176872163) is 6-[(E)-but-1-enyl]-4-methylquinoline.
What is the SMILES notation for 6-[(E)-but-1-enyl]-4-methylquinoline?
The canonical SMILES for 6-[(E)-but-1-enyl]-4-methylquinoline is CC/C=C/c1ccc2nccc(C)c2c1.
What is the InChIKey of 6-[(E)-but-1-enyl]-4-methylquinoline?
The InChIKey is UHSWDZKPMPNAHS-SNAWJCMRSA-N. The full InChI is InChI=1S/C14H15N/c1-3-4-5-12-6-7-14-13(10-12)11(2)8-9-15-14/h4-10H,3H2,1-2H3/b5-4+.
What are the key properties of 6-[(E)-but-1-enyl]-4-methylquinoline?
6-[(E)-but-1-enyl]-4-methylquinoline has a molecular weight of 197.28 g/mol, XLogP of 3.97, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(E)-but-1-enyl]-4-methylquinoline is sourced from PubChem (CID 176872163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).