5-(4-ethylcyclohexyl)-2-[(Z)-2-[4-(4-propylcyclohexyl)phenyl]ethenyl]pyridine

C30H41N — CID 92971949

IUPAC5-(4-ethylcyclohexyl)-2-[(Z)-2-[4-(4-propylcyclohexyl)phenyl]ethenyl]pyridine
SMILESCCCC1CCC(c2ccc(/C=C\c3ccc(C4CCC(CC)CC4)cn3)cc2)CC1
InChIInChI=1S/C30H41N/c1-3-5-24-8-15-26(16-9-24)27-17-10-25(11-18-27)12-20-30-21-19-29(22-31-30)28-13-6-23(4-2)7-14-28/h10-12,17-24,26,28H,3-9,13-16H2,1-2H3/b20-12-
InChIKeyZCIYSSLIULSEEB-NDENLUEZSA-N
MW415.67 g/mol
LogP9.01
Rot. Bonds7

About 5-(4-ethylcyclohexyl)-2-[(Z)-2-[4-(4-propylcyclohexyl)phenyl]ethenyl]pyridine

5-(4-ethylcyclohexyl)-2-[(Z)-2-[4-(4-propylcyclohexyl)phenyl]ethenyl]pyridine (PubChem CID 92971949) has the molecular formula C30H41N and a molecular weight of 415.67 g/mol. Its IUPAC name is 5-(4-ethylcyclohexyl)-2-[(Z)-2-[4-(4-propylcyclohexyl)phenyl]ethenyl]pyridine.

Molecular Properties

Compound Name5-(4-ethylcyclohexyl)-2-[(Z)-2-[4-(4-propylcyclohexyl)phenyl]ethenyl]pyridine
PubChem CID92971949
Molecular FormulaC30H41N
Molecular Weight415.67 g/mol
Exact Mass415.32
IUPAC Name5-(4-ethylcyclohexyl)-2-[(Z)-2-[4-(4-propylcyclohexyl)phenyl]ethenyl]pyridine
SMILESCCCC1CCC(c2ccc(/C=C\c3ccc(C4CCC(CC)CC4)cn3)cc2)CC1
InChIInChI=1S/C30H41N/c1-3-5-24-8-15-26(16-9-24)27-17-10-25(11-18-27)12-20-30-21-19-29(22-31-30)28-13-6-23(4-2)7-14-28/h10-12,17-24,26,28H,3-9,13-16H2,1-2H3/b20-12-
InChIKeyZCIYSSLIULSEEB-NDENLUEZSA-N
XLogP9.01
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500415.67
LogP ≤ 59.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-(4-ethylcyclohexyl)-4-(4-propylcyclohexyl)benzene
CID 20538372
1-ethyl-4-[2-[4-(4-propylcyclohexyl)phenyl]ethenyl]benzene
CID 141224926
1-chloro-4-[(E)-2-[4-[4-[2-(4-propylcyclohexyl)ethyl]cyclohexyl]phenyl]ethenyl]benzene
CID 67590386
pentafluoro-[4-[(E)-2-[4-(4-propylcyclohexyl)phenyl]ethenyl]phenyl]-λ6-sulfane
CID 25197320
1-[(E)-prop-1-enyl]-4-[4-(4-propylcyclohexyl)cyclohexyl]benzene
CID 59247481
4-(4-propylcyclohexyl)benzaldehyde
CID 14573359
1-[(E)-prop-1-enyl]-4-[2-[4-(4-propylcyclohexyl)phenyl]ethyl]benzene
CID 22991361
3-[4-(4-propylcyclohexyl)phenyl]prop-2-enoic acid
CID 4201535
1-(4-ethenylcyclohexyl)-4-[(E)-2-(4-propylcyclohexyl)ethenyl]benzene
CID 173068049
tris(1-(4-butylcyclohexyl)-4-methylbenzene);tetrakis(1-(4-ethylcyclohexyl)-4-methylbenzene);tetrakis(1-methyl-4-(4-propylcyclohexyl)benzene)
CID 158284409
1,3-difluoro-5-[(E)-2-[4-(4-propylcyclohexyl)phenyl]ethenyl]-2-(3,3,3-trifluoroprop-1-ynyl)benzene
CID 59247028
1-(4-ethylcyclohexyl)-4-(4-octylcyclohexyl)benzene
CID 20538252

Frequently Asked Questions

What is the IUPAC name of 5-(4-ethylcyclohexyl)-2-[(Z)-2-[4-(4-propylcyclohexyl)phenyl]ethenyl]pyridine?
The IUPAC name of 5-(4-ethylcyclohexyl)-2-[(Z)-2-[4-(4-propylcyclohexyl)phenyl]ethenyl]pyridine (CID 92971949) is 5-(4-ethylcyclohexyl)-2-[(Z)-2-[4-(4-propylcyclohexyl)phenyl]ethenyl]pyridine.
What is the SMILES notation for 5-(4-ethylcyclohexyl)-2-[(Z)-2-[4-(4-propylcyclohexyl)phenyl]ethenyl]pyridine?
The canonical SMILES for 5-(4-ethylcyclohexyl)-2-[(Z)-2-[4-(4-propylcyclohexyl)phenyl]ethenyl]pyridine is CCCC1CCC(c2ccc(/C=C\c3ccc(C4CCC(CC)CC4)cn3)cc2)CC1.
What is the InChIKey of 5-(4-ethylcyclohexyl)-2-[(Z)-2-[4-(4-propylcyclohexyl)phenyl]ethenyl]pyridine?
The InChIKey is ZCIYSSLIULSEEB-NDENLUEZSA-N. The full InChI is InChI=1S/C30H41N/c1-3-5-24-8-15-26(16-9-24)27-17-10-25(11-18-27)12-20-30-21-19-29(22-31-30)28-13-6-23(4-2)7-14-28/h10-12,17-24,26,28H,3-9,13-16H2,1-2H3/b20-12-.
What are the key properties of 5-(4-ethylcyclohexyl)-2-[(Z)-2-[4-(4-propylcyclohexyl)phenyl]ethenyl]pyridine?
5-(4-ethylcyclohexyl)-2-[(Z)-2-[4-(4-propylcyclohexyl)phenyl]ethenyl]pyridine has a molecular weight of 415.67 g/mol, XLogP of 9.01, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-ethylcyclohexyl)-2-[(Z)-2-[4-(4-propylcyclohexyl)phenyl]ethenyl]pyridine is sourced from PubChem (CID 92971949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).