2-[5-phenyl-2-[(Z)-prop-1-enyl]phenyl]-1,2-dihydropyridine

C20H19N — CID 129229858

IUPAC2-[5-phenyl-2-[(Z)-prop-1-enyl]phenyl]-1,2-dihydropyridine
SMILESC/C=C\c1ccc(-c2ccccc2)cc1C1C=CC=CN1
InChIInChI=1S/C20H19N/c1-2-8-17-12-13-18(16-9-4-3-5-10-16)15-19(17)20-11-6-7-14-21-20/h2-15,20-21H,1H3/b8-2-
InChIKeyGUAWHRFLXNIMNS-WAPJZHGLSA-N
MW273.38 g/mol
LogP5.10
Rot. Bonds3

About 2-[5-phenyl-2-[(Z)-prop-1-enyl]phenyl]-1,2-dihydropyridine

2-[5-phenyl-2-[(Z)-prop-1-enyl]phenyl]-1,2-dihydropyridine (PubChem CID 129229858) has the molecular formula C20H19N and a molecular weight of 273.38 g/mol. Its IUPAC name is 2-[5-phenyl-2-[(Z)-prop-1-enyl]phenyl]-1,2-dihydropyridine.

Molecular Properties

Compound Name2-[5-phenyl-2-[(Z)-prop-1-enyl]phenyl]-1,2-dihydropyridine
PubChem CID129229858
Molecular FormulaC20H19N
Molecular Weight273.38 g/mol
Exact Mass273.15
IUPAC Name2-[5-phenyl-2-[(Z)-prop-1-enyl]phenyl]-1,2-dihydropyridine
SMILESC/C=C\c1ccc(-c2ccccc2)cc1C1C=CC=CN1
InChIInChI=1S/C20H19N/c1-2-8-17-12-13-18(16-9-4-3-5-10-16)15-19(17)20-11-6-7-14-21-20/h2-15,20-21H,1H3/b8-2-
InChIKeyGUAWHRFLXNIMNS-WAPJZHGLSA-N
XLogP5.10
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500273.38
LogP ≤ 55.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-[5-phenyl-2-[(Z)-prop-1-enyl]phenyl]-1,2-dihydropyridine?
The IUPAC name of 2-[5-phenyl-2-[(Z)-prop-1-enyl]phenyl]-1,2-dihydropyridine (CID 129229858) is 2-[5-phenyl-2-[(Z)-prop-1-enyl]phenyl]-1,2-dihydropyridine.
What is the SMILES notation for 2-[5-phenyl-2-[(Z)-prop-1-enyl]phenyl]-1,2-dihydropyridine?
The canonical SMILES for 2-[5-phenyl-2-[(Z)-prop-1-enyl]phenyl]-1,2-dihydropyridine is C/C=C\c1ccc(-c2ccccc2)cc1C1C=CC=CN1.
What is the InChIKey of 2-[5-phenyl-2-[(Z)-prop-1-enyl]phenyl]-1,2-dihydropyridine?
The InChIKey is GUAWHRFLXNIMNS-WAPJZHGLSA-N. The full InChI is InChI=1S/C20H19N/c1-2-8-17-12-13-18(16-9-4-3-5-10-16)15-19(17)20-11-6-7-14-21-20/h2-15,20-21H,1H3/b8-2-.
What are the key properties of 2-[5-phenyl-2-[(Z)-prop-1-enyl]phenyl]-1,2-dihydropyridine?
2-[5-phenyl-2-[(Z)-prop-1-enyl]phenyl]-1,2-dihydropyridine has a molecular weight of 273.38 g/mol, XLogP of 5.10, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-phenyl-2-[(Z)-prop-1-enyl]phenyl]-1,2-dihydropyridine is sourced from PubChem (CID 129229858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).