N-[2-[4-(4-ethenylphenyl)phenyl]quinolin-4-yl]formamide;methane

C25H22N2O — CID 145464868

IUPACN-[2-[4-(4-ethenylphenyl)phenyl]quinolin-4-yl]formamide;methane
SMILESC.C=Cc1ccc(-c2ccc(-c3cc(NC=O)c4ccccc4n3)cc2)cc1
InChIInChI=1S/C24H18N2O.CH4/c1-2-17-7-9-18(10-8-17)19-11-13-20(14-12-19)23-15-24(25-16-27)21-5-3-4-6-22(21)26-23;/h2-16H,1H2,(H,25,26,27);1H4
InChIKeyRSIIXFRXJWNORP-UHFFFAOYSA-N
MW366.46 g/mol
LogP6.42
Rot. Bonds5

About N-[2-[4-(4-ethenylphenyl)phenyl]quinolin-4-yl]formamide;methane

N-[2-[4-(4-ethenylphenyl)phenyl]quinolin-4-yl]formamide;methane (PubChem CID 145464868) has the molecular formula C25H22N2O and a molecular weight of 366.46 g/mol. Its IUPAC name is N-[2-[4-(4-ethenylphenyl)phenyl]quinolin-4-yl]formamide;methane.

Molecular Properties

Compound NameN-[2-[4-(4-ethenylphenyl)phenyl]quinolin-4-yl]formamide;methane
PubChem CID145464868
Molecular FormulaC25H22N2O
Molecular Weight366.46 g/mol
Exact Mass366.17
IUPAC NameN-[2-[4-(4-ethenylphenyl)phenyl]quinolin-4-yl]formamide;methane
SMILESC.C=Cc1ccc(-c2ccc(-c3cc(NC=O)c4ccccc4n3)cc2)cc1
InChIInChI=1S/C24H18N2O.CH4/c1-2-17-7-9-18(10-8-17)19-11-13-20(14-12-19)23-15-24(25-16-27)21-5-3-4-6-22(21)26-23;/h2-16H,1H2,(H,25,26,27);1H4
InChIKeyRSIIXFRXJWNORP-UHFFFAOYSA-N
XLogP6.42
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500366.46
LogP ≤ 56.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

N-ethenyl-2-[4-(4-prop-1-en-2-ylphenyl)phenyl]quinolin-4-amine
CID 145465454
4-[4-(4-ethenylphenyl)phenyl]-2,6-bis(4-phenylphenyl)pyridine
CID 58151660
N-(2-aminoquinolin-4-yl)formamide
CID 87318709
3-(4-ethenylphenyl)-4-azatetracyclo[7.6.1.05,16.010,15]hexadeca-1,3,5,7,9(16),10,12,14-octaene
CID 59621646
2-[4-(4-ethenylphenyl)phenyl]-3,5,6-triphenylpyrazine
CID 58151656
[4-(4-formamido-1,5-naphthyridin-2-yl)phenyl] thiohypofluorite
CID 145465272
N-acridin-1-ylformamide
CID 174650417
N,2-bis(4-methoxyphenyl)quinolin-4-amine
CID 10981160
N,N'-bis(2-phenylquinolin-4-yl)octane-1,8-diamine;hydrochloride
CID 44531954
2-phenylquinoline-4-carboxylic acid;prop-1-ene
CID 143187114
N-methyl-2-naphthalen-2-ylquinolin-4-amine
CID 142840384
N-cinnolin-4-ylformamide
CID 87322157

Frequently Asked Questions

What is the IUPAC name of N-[2-[4-(4-ethenylphenyl)phenyl]quinolin-4-yl]formamide;methane?
The IUPAC name of N-[2-[4-(4-ethenylphenyl)phenyl]quinolin-4-yl]formamide;methane (CID 145464868) is N-[2-[4-(4-ethenylphenyl)phenyl]quinolin-4-yl]formamide;methane.
What is the SMILES notation for N-[2-[4-(4-ethenylphenyl)phenyl]quinolin-4-yl]formamide;methane?
The canonical SMILES for N-[2-[4-(4-ethenylphenyl)phenyl]quinolin-4-yl]formamide;methane is C.C=Cc1ccc(-c2ccc(-c3cc(NC=O)c4ccccc4n3)cc2)cc1.
What is the InChIKey of N-[2-[4-(4-ethenylphenyl)phenyl]quinolin-4-yl]formamide;methane?
The InChIKey is RSIIXFRXJWNORP-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18N2O.CH4/c1-2-17-7-9-18(10-8-17)19-11-13-20(14-12-19)23-15-24(25-16-27)21-5-3-4-6-22(21)26-23;/h2-16H,1H2,(H,25,26,27);1H4.
What are the key properties of N-[2-[4-(4-ethenylphenyl)phenyl]quinolin-4-yl]formamide;methane?
N-[2-[4-(4-ethenylphenyl)phenyl]quinolin-4-yl]formamide;methane has a molecular weight of 366.46 g/mol, XLogP of 6.42, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[4-(4-ethenylphenyl)phenyl]quinolin-4-yl]formamide;methane is sourced from PubChem (CID 145464868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).