7-ethyl-4-methyl-2-phenyl-3,8-bis[(Z)-prop-1-enyl]quinoline

C24H25N — CID 166885144

IUPAC7-ethyl-4-methyl-2-phenyl-3,8-bis[(Z)-prop-1-enyl]quinoline
SMILESC/C=C\c1c(-c2ccccc2)nc2c(/C=C\C)c(CC)ccc2c1C
InChIInChI=1S/C24H25N/c1-5-11-20-17(4)21-16-15-18(7-3)22(12-6-2)24(21)25-23(20)19-13-9-8-10-14-19/h5-6,8-16H,7H2,1-4H3/b11-5-,12-6-
InChIKeyUXIDFQSVLFUHKZ-CBIKUMSCSA-N
MW327.47 g/mol
LogP6.84
Rot. Bonds4

About 7-ethyl-4-methyl-2-phenyl-3,8-bis[(Z)-prop-1-enyl]quinoline

7-ethyl-4-methyl-2-phenyl-3,8-bis[(Z)-prop-1-enyl]quinoline (PubChem CID 166885144) has the molecular formula C24H25N and a molecular weight of 327.47 g/mol. Its IUPAC name is 7-ethyl-4-methyl-2-phenyl-3,8-bis[(Z)-prop-1-enyl]quinoline.

Molecular Properties

Compound Name7-ethyl-4-methyl-2-phenyl-3,8-bis[(Z)-prop-1-enyl]quinoline
PubChem CID166885144
Molecular FormulaC24H25N
Molecular Weight327.47 g/mol
Exact Mass327.20
IUPAC Name7-ethyl-4-methyl-2-phenyl-3,8-bis[(Z)-prop-1-enyl]quinoline
SMILESC/C=C\c1c(-c2ccccc2)nc2c(/C=C\C)c(CC)ccc2c1C
InChIInChI=1S/C24H25N/c1-5-11-20-17(4)21-16-15-18(7-3)22(12-6-2)24(21)25-23(20)19-13-9-8-10-14-19/h5-6,8-16H,7H2,1-4H3/b11-5-,12-6-
InChIKeyUXIDFQSVLFUHKZ-CBIKUMSCSA-N
XLogP6.84
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500327.47
LogP ≤ 56.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 7-ethyl-4-methyl-2-phenyl-3,8-bis[(Z)-prop-1-enyl]quinoline?
The IUPAC name of 7-ethyl-4-methyl-2-phenyl-3,8-bis[(Z)-prop-1-enyl]quinoline (CID 166885144) is 7-ethyl-4-methyl-2-phenyl-3,8-bis[(Z)-prop-1-enyl]quinoline.
What is the SMILES notation for 7-ethyl-4-methyl-2-phenyl-3,8-bis[(Z)-prop-1-enyl]quinoline?
The canonical SMILES for 7-ethyl-4-methyl-2-phenyl-3,8-bis[(Z)-prop-1-enyl]quinoline is C/C=C\c1c(-c2ccccc2)nc2c(/C=C\C)c(CC)ccc2c1C.
What is the InChIKey of 7-ethyl-4-methyl-2-phenyl-3,8-bis[(Z)-prop-1-enyl]quinoline?
The InChIKey is UXIDFQSVLFUHKZ-CBIKUMSCSA-N. The full InChI is InChI=1S/C24H25N/c1-5-11-20-17(4)21-16-15-18(7-3)22(12-6-2)24(21)25-23(20)19-13-9-8-10-14-19/h5-6,8-16H,7H2,1-4H3/b11-5-,12-6-.
What are the key properties of 7-ethyl-4-methyl-2-phenyl-3,8-bis[(Z)-prop-1-enyl]quinoline?
7-ethyl-4-methyl-2-phenyl-3,8-bis[(Z)-prop-1-enyl]quinoline has a molecular weight of 327.47 g/mol, XLogP of 6.84, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethyl-4-methyl-2-phenyl-3,8-bis[(Z)-prop-1-enyl]quinoline is sourced from PubChem (CID 166885144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).