4-[1-(4-methoxyphenyl)ethenyl]quinoline-2-carbonitrile

C19H14N2O — CID 118443998

IUPAC4-[1-(4-methoxyphenyl)ethenyl]quinoline-2-carbonitrile
SMILESC=C(c1ccc(OC)cc1)c1cc(C#N)nc2ccccc12
InChIInChI=1S/C19H14N2O/c1-13(14-7-9-16(22-2)10-8-14)18-11-15(12-20)21-19-6-4-3-5-17(18)19/h3-11H,1H2,2H3
InChIKeyNXQPEOJBNVLIDQ-UHFFFAOYSA-N
MW286.33 g/mol
LogP4.18
Rot. Bonds3

About 4-[1-(4-methoxyphenyl)ethenyl]quinoline-2-carbonitrile

4-[1-(4-methoxyphenyl)ethenyl]quinoline-2-carbonitrile (PubChem CID 118443998) has the molecular formula C19H14N2O and a molecular weight of 286.33 g/mol. Its IUPAC name is 4-[1-(4-methoxyphenyl)ethenyl]quinoline-2-carbonitrile.

Molecular Properties

Compound Name4-[1-(4-methoxyphenyl)ethenyl]quinoline-2-carbonitrile
PubChem CID118443998
Molecular FormulaC19H14N2O
Molecular Weight286.33 g/mol
Exact Mass286.11
IUPAC Name4-[1-(4-methoxyphenyl)ethenyl]quinoline-2-carbonitrile
SMILESC=C(c1ccc(OC)cc1)c1cc(C#N)nc2ccccc12
InChIInChI=1S/C19H14N2O/c1-13(14-7-9-16(22-2)10-8-14)18-11-15(12-20)21-19-6-4-3-5-17(18)19/h3-11H,1H2,2H3
InChIKeyNXQPEOJBNVLIDQ-UHFFFAOYSA-N
XLogP4.18
TPSA45.91 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 54.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

6-Methoxy-1,2,3,4-tetrahydroacridin-9-amine
CID 3075610
4-Amino-6-methoxy-2-(trifluoromethyl)-3-quinolinecarbonitrile
CID 824060
7-Methoxytacrine
CID 119053
9-Acridinamine, 1,2,3,4-tetrahydro-N-heptyl-6-methoxy-
CID 3075611
9-Amino-2-methoxyacridine
CID 18867
Acridine, 9-(p-anisidino)-
CID 43640
2-Methoxy-4,6-diphenylpyridine-3-carbonitrile
CID 678565
2-(4-Methoxy-phenyl)-3-phenyl-quinoxaline
CID 687304
6-Methoxyquinaldine
CID 70648
8-Methoxy-2-Methylquinoline
CID 316986
9-Methoxyacridine
CID 99383
2-(4-Methoxyphenyl)quinoline
CID 1481967

Frequently Asked Questions

What is the IUPAC name of 4-[1-(4-methoxyphenyl)ethenyl]quinoline-2-carbonitrile?
The IUPAC name of 4-[1-(4-methoxyphenyl)ethenyl]quinoline-2-carbonitrile (CID 118443998) is 4-[1-(4-methoxyphenyl)ethenyl]quinoline-2-carbonitrile.
What is the SMILES notation for 4-[1-(4-methoxyphenyl)ethenyl]quinoline-2-carbonitrile?
The canonical SMILES for 4-[1-(4-methoxyphenyl)ethenyl]quinoline-2-carbonitrile is C=C(c1ccc(OC)cc1)c1cc(C#N)nc2ccccc12.
What is the InChIKey of 4-[1-(4-methoxyphenyl)ethenyl]quinoline-2-carbonitrile?
The InChIKey is NXQPEOJBNVLIDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14N2O/c1-13(14-7-9-16(22-2)10-8-14)18-11-15(12-20)21-19-6-4-3-5-17(18)19/h3-11H,1H2,2H3.
What are the key properties of 4-[1-(4-methoxyphenyl)ethenyl]quinoline-2-carbonitrile?
4-[1-(4-methoxyphenyl)ethenyl]quinoline-2-carbonitrile has a molecular weight of 286.33 g/mol, XLogP of 4.18, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(4-methoxyphenyl)ethenyl]quinoline-2-carbonitrile is sourced from PubChem (CID 118443998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).