3-[4-(3,4-dihydro-2H-quinolin-1-yl)phenyl]propan-1-amine

C18H22N2 — CID 82304536

IUPAC3-[4-(3,4-dihydro-2H-quinolin-1-yl)phenyl]propan-1-amine
SMILESNCCCc1ccc(N2CCCc3ccccc32)cc1
InChIInChI=1S/C18H22N2/c19-13-3-5-15-9-11-17(12-10-15)20-14-4-7-16-6-1-2-8-18(16)20/h1-2,6,8-12H,3-5,7,13-14,19H2
InChIKeyNOANEYWTNXFWJB-UHFFFAOYSA-N
MW266.39 g/mol
LogP3.66
Rot. Bonds4

About 3-[4-(3,4-dihydro-2H-quinolin-1-yl)phenyl]propan-1-amine

3-[4-(3,4-dihydro-2H-quinolin-1-yl)phenyl]propan-1-amine (PubChem CID 82304536) has the molecular formula C18H22N2 and a molecular weight of 266.39 g/mol. Its IUPAC name is 3-[4-(3,4-dihydro-2H-quinolin-1-yl)phenyl]propan-1-amine.

Molecular Properties

Compound Name3-[4-(3,4-dihydro-2H-quinolin-1-yl)phenyl]propan-1-amine
PubChem CID82304536
Molecular FormulaC18H22N2
Molecular Weight266.39 g/mol
Exact Mass266.18
IUPAC Name3-[4-(3,4-dihydro-2H-quinolin-1-yl)phenyl]propan-1-amine
SMILESNCCCc1ccc(N2CCCc3ccccc32)cc1
InChIInChI=1S/C18H22N2/c19-13-3-5-15-9-11-17(12-10-15)20-14-4-7-16-6-1-2-8-18(16)20/h1-2,6,8-12H,3-5,7,13-14,19H2
InChIKeyNOANEYWTNXFWJB-UHFFFAOYSA-N
XLogP3.66
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.39
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-[4-(3,4-dihydro-2H-quinolin-1-yl)phenyl]propan-1-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

1-[4-(chloromethyl)phenyl]-3,4-dihydro-2H-quinoline
CID 28946417
ethane;1-phenyl-3,4-dihydro-2H-quinoline
CID 145126037
2-[4-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)phenyl]ethanamine
CID 63784065
1-[4-(bromomethyl)phenyl]-2,3-dihydroindole
CID 107079450
1-[4-[2-(4-methylcyclohexyl)ethyl]phenyl]-2,3-dihydroindole
CID 59549688
6-(3,4-dihydro-2H-quinolin-1-yl)hexan-1-amine
CID 13472128
8-(3,4-dihydro-2H-quinolin-1-yl)octan-1-amine
CID 13472131
1-(3-ethylphenyl)-3,4-dihydro-2H-quinoline
CID 67553271
N-[4-(3,4-dihydro-2H-quinolin-1-yl)phenyl]ethanesulfonamide
CID 112986280
9-[4-[4-(3,4-dihydro-2H-quinolin-1-yl)phenyl]phenyl]carbazole
CID 90215596
4-(3,4-dihydro-2H-quinolin-1-yl)-2-ethoxyaniline
CID 63670067
4-(3,4-dihydro-2H-quinolin-1-yl)pentan-1-amine
CID 62425766

Frequently Asked Questions

What is the IUPAC name of 3-[4-(3,4-dihydro-2H-quinolin-1-yl)phenyl]propan-1-amine?
The IUPAC name of 3-[4-(3,4-dihydro-2H-quinolin-1-yl)phenyl]propan-1-amine (CID 82304536) is 3-[4-(3,4-dihydro-2H-quinolin-1-yl)phenyl]propan-1-amine.
What is the SMILES notation for 3-[4-(3,4-dihydro-2H-quinolin-1-yl)phenyl]propan-1-amine?
The canonical SMILES for 3-[4-(3,4-dihydro-2H-quinolin-1-yl)phenyl]propan-1-amine is NCCCc1ccc(N2CCCc3ccccc32)cc1.
What is the InChIKey of 3-[4-(3,4-dihydro-2H-quinolin-1-yl)phenyl]propan-1-amine?
The InChIKey is NOANEYWTNXFWJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2/c19-13-3-5-15-9-11-17(12-10-15)20-14-4-7-16-6-1-2-8-18(16)20/h1-2,6,8-12H,3-5,7,13-14,19H2.
What are the key properties of 3-[4-(3,4-dihydro-2H-quinolin-1-yl)phenyl]propan-1-amine?
3-[4-(3,4-dihydro-2H-quinolin-1-yl)phenyl]propan-1-amine has a molecular weight of 266.39 g/mol, XLogP of 3.66, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-(3,4-dihydro-2H-quinolin-1-yl)phenyl]propan-1-amine is sourced from PubChem (CID 82304536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).