N-phenyl-3-prop-2-enylquinolin-2-amine

C18H16N2 — CID 132549731

IUPACN-phenyl-3-prop-2-enylquinolin-2-amine
SMILESC=CCc1cc2ccccc2nc1Nc1ccccc1
InChIInChI=1S/C18H16N2/c1-2-8-15-13-14-9-6-7-12-17(14)20-18(15)19-16-10-4-3-5-11-16/h2-7,9-13H,1,8H2,(H,19,20)
InChIKeyQMUXXQIITIZVNY-UHFFFAOYSA-N
MW260.34 g/mol
LogP4.71
Rot. Bonds4

About N-phenyl-3-prop-2-enylquinolin-2-amine

N-phenyl-3-prop-2-enylquinolin-2-amine (PubChem CID 132549731) has the molecular formula C18H16N2 and a molecular weight of 260.34 g/mol. Its IUPAC name is N-phenyl-3-prop-2-enylquinolin-2-amine.

Molecular Properties

Compound NameN-phenyl-3-prop-2-enylquinolin-2-amine
PubChem CID132549731
Molecular FormulaC18H16N2
Molecular Weight260.34 g/mol
Exact Mass260.13
IUPAC NameN-phenyl-3-prop-2-enylquinolin-2-amine
SMILESC=CCc1cc2ccccc2nc1Nc1ccccc1
InChIInChI=1S/C18H16N2/c1-2-8-15-13-14-9-6-7-12-17(14)20-18(15)19-16-10-4-3-5-11-16/h2-7,9-13H,1,8H2,(H,19,20)
InChIKeyQMUXXQIITIZVNY-UHFFFAOYSA-N
XLogP4.71
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 54.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-phenyl-3-prop-2-enylquinolin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-prop-2-enylquinolin-2-amine;hydrochloride
CID 69457689
N-phenyl-3-(phenyliminomethyl)quinolin-2-amine
CID 146000832
N-(4-prop-2-enylphenyl)quinazolin-2-amine
CID 174758474
1-N-methyl-4-N-(3-methylquinolin-2-yl)benzene-1,4-diamine
CID 154949074
2,6-dimethoxy-N-phenyl-5-prop-2-enylpyrimidin-4-amine
CID 134843969
N-(2-prop-2-enylphenyl)naphthalen-2-amine
CID 66931436
N-ethyl-3-propylquinolin-2-amine
CID 63232591
N-prop-2-enylcinnolin-3-amine
CID 69404307
3-benzylquinoline-2-thiolate
CID 7383405
2-N-(4-anilinophenyl)-3-N-phenylsulfanylquinoxaline-2,3-diamine
CID 143442867
2-[2-(4-methylanilino)quinolin-3-yl]-N-(4-methylphenyl)quinazolin-4-amine
CID 132500565
3-phenyl-N-(4-phenylphenyl)quinoxalin-2-amine
CID 166918238

Frequently Asked Questions

What is the IUPAC name of N-phenyl-3-prop-2-enylquinolin-2-amine?
The IUPAC name of N-phenyl-3-prop-2-enylquinolin-2-amine (CID 132549731) is N-phenyl-3-prop-2-enylquinolin-2-amine.
What is the SMILES notation for N-phenyl-3-prop-2-enylquinolin-2-amine?
The canonical SMILES for N-phenyl-3-prop-2-enylquinolin-2-amine is C=CCc1cc2ccccc2nc1Nc1ccccc1.
What is the InChIKey of N-phenyl-3-prop-2-enylquinolin-2-amine?
The InChIKey is QMUXXQIITIZVNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2/c1-2-8-15-13-14-9-6-7-12-17(14)20-18(15)19-16-10-4-3-5-11-16/h2-7,9-13H,1,8H2,(H,19,20).
What are the key properties of N-phenyl-3-prop-2-enylquinolin-2-amine?
N-phenyl-3-prop-2-enylquinolin-2-amine has a molecular weight of 260.34 g/mol, XLogP of 4.71, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-3-prop-2-enylquinolin-2-amine is sourced from PubChem (CID 132549731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).