1-(3,4-dihydro-2H-quinolin-1-yl)-4-phenylbutan-2-amine

C19H24N2 — CID 114929496

IUPAC1-(3,4-dihydro-2H-quinolin-1-yl)-4-phenylbutan-2-amine
SMILESNC(CCc1ccccc1)CN1CCCc2ccccc21
InChIInChI=1S/C19H24N2/c20-18(13-12-16-7-2-1-3-8-16)15-21-14-6-10-17-9-4-5-11-19(17)21/h1-5,7-9,11,18H,6,10,12-15,20H2
InChIKeyJUAHEYKRUIOYBC-UHFFFAOYSA-N
MW280.42 g/mol
LogP3.40
Rot. Bonds5

About 1-(3,4-dihydro-2H-quinolin-1-yl)-4-phenylbutan-2-amine

1-(3,4-dihydro-2H-quinolin-1-yl)-4-phenylbutan-2-amine (PubChem CID 114929496) has the molecular formula C19H24N2 and a molecular weight of 280.42 g/mol. Its IUPAC name is 1-(3,4-dihydro-2H-quinolin-1-yl)-4-phenylbutan-2-amine.

Molecular Properties

Compound Name1-(3,4-dihydro-2H-quinolin-1-yl)-4-phenylbutan-2-amine
PubChem CID114929496
Molecular FormulaC19H24N2
Molecular Weight280.42 g/mol
Exact Mass280.19
IUPAC Name1-(3,4-dihydro-2H-quinolin-1-yl)-4-phenylbutan-2-amine
SMILESNC(CCc1ccccc1)CN1CCCc2ccccc21
InChIInChI=1S/C19H24N2/c20-18(13-12-16-7-2-1-3-8-16)15-21-14-6-10-17-9-4-5-11-19(17)21/h1-5,7-9,11,18H,6,10,12-15,20H2
InChIKeyJUAHEYKRUIOYBC-UHFFFAOYSA-N
XLogP3.40
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.42
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(3,4-dihydro-2H-quinolin-1-yl)-4-phenylbutan-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

1-(3,4-dihydro-2H-quinolin-1-yl)-4-methoxybutan-2-amine
CID 62476969
1-(6-fluoro-2,3-dihydroindol-1-yl)-4-phenylbutan-2-amine
CID 103497278
1-(3,4-dihydro-2H-quinolin-1-yl)-3-methoxypropan-2-amine
CID 81101379
4-phenyl-1-pyrrolidin-1-ylbutan-2-amine
CID 114929475
ethane;1-(2-methylpropyl)-3,4-dihydro-2H-quinoline
CID 170597916
(2S)-1-(2,3-dihydroindol-1-yl)-4-methylsulfanylbutan-2-amine
CID 22689711
(2S,11R)-1,12-bis(3,4-dihydro-2H-quinolin-1-yl)dodecane-2,11-diol
CID 92532372
1-(3,4-dihydro-2H-quinolin-1-yl)-3-phenylmethoxypropan-2-ol
CID 3804893
4-(3,4-dihydro-2H-quinolin-1-yl)-3,3-dimethylbutan-2-amine
CID 66454044
2-amino-4-(3,4-dihydro-2H-quinolin-1-yl)butanenitrile
CID 63028093
(2R)-3-(3,4-dihydro-2H-quinolin-1-yl)-2-iodo-N-phenylpropanamide
CID 126537248
2-[3-(3,4-dihydro-2H-quinolin-1-yl)-2-hydroxypropyl]guanidine
CID 3095129

Frequently Asked Questions

What is the IUPAC name of 1-(3,4-dihydro-2H-quinolin-1-yl)-4-phenylbutan-2-amine?
The IUPAC name of 1-(3,4-dihydro-2H-quinolin-1-yl)-4-phenylbutan-2-amine (CID 114929496) is 1-(3,4-dihydro-2H-quinolin-1-yl)-4-phenylbutan-2-amine.
What is the SMILES notation for 1-(3,4-dihydro-2H-quinolin-1-yl)-4-phenylbutan-2-amine?
The canonical SMILES for 1-(3,4-dihydro-2H-quinolin-1-yl)-4-phenylbutan-2-amine is NC(CCc1ccccc1)CN1CCCc2ccccc21.
What is the InChIKey of 1-(3,4-dihydro-2H-quinolin-1-yl)-4-phenylbutan-2-amine?
The InChIKey is JUAHEYKRUIOYBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2/c20-18(13-12-16-7-2-1-3-8-16)15-21-14-6-10-17-9-4-5-11-19(17)21/h1-5,7-9,11,18H,6,10,12-15,20H2.
What are the key properties of 1-(3,4-dihydro-2H-quinolin-1-yl)-4-phenylbutan-2-amine?
1-(3,4-dihydro-2H-quinolin-1-yl)-4-phenylbutan-2-amine has a molecular weight of 280.42 g/mol, XLogP of 3.40, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,4-dihydro-2H-quinolin-1-yl)-4-phenylbutan-2-amine is sourced from PubChem (CID 114929496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).