2-cyclopropyl-3-(3,4-dihydro-2H-quinolin-1-yl)-2-(propylamino)propan-1-ol

C18H28N2O — CID 64798243

IUPAC2-cyclopropyl-3-(3,4-dihydro-2H-quinolin-1-yl)-2-(propylamino)propan-1-ol
SMILESCCCNC(CO)(CN1CCCc2ccccc21)C1CC1
InChIInChI=1S/C18H28N2O/c1-2-11-19-18(14-21,16-9-10-16)13-20-12-5-7-15-6-3-4-8-17(15)20/h3-4,6,8,16,19,21H,2,5,7,9-14H2,1H3
InChIKeyNIJJIFKCMQPXTF-UHFFFAOYSA-N
MW288.44 g/mol
LogP2.58
Rot. Bonds7

About 2-cyclopropyl-3-(3,4-dihydro-2H-quinolin-1-yl)-2-(propylamino)propan-1-ol

2-cyclopropyl-3-(3,4-dihydro-2H-quinolin-1-yl)-2-(propylamino)propan-1-ol (PubChem CID 64798243) has the molecular formula C18H28N2O and a molecular weight of 288.44 g/mol. Its IUPAC name is 2-cyclopropyl-3-(3,4-dihydro-2H-quinolin-1-yl)-2-(propylamino)propan-1-ol.

Molecular Properties

Compound Name2-cyclopropyl-3-(3,4-dihydro-2H-quinolin-1-yl)-2-(propylamino)propan-1-ol
PubChem CID64798243
Molecular FormulaC18H28N2O
Molecular Weight288.44 g/mol
Exact Mass288.22
IUPAC Name2-cyclopropyl-3-(3,4-dihydro-2H-quinolin-1-yl)-2-(propylamino)propan-1-ol
SMILESCCCNC(CO)(CN1CCCc2ccccc21)C1CC1
InChIInChI=1S/C18H28N2O/c1-2-11-19-18(14-21,16-9-10-16)13-20-12-5-7-15-6-3-4-8-17(15)20/h3-4,6,8,16,19,21H,2,5,7,9-14H2,1H3
InChIKeyNIJJIFKCMQPXTF-UHFFFAOYSA-N
XLogP2.58
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.44
LogP ≤ 52.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-cyclopropyl-3-(3,4-dihydro-2H-quinolin-1-yl)-2-(propylamino)propan-1-ol 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

2-cyclopropyl-3-(3,4-dihydro-2H-quinolin-1-yl)-2-(methylamino)propan-1-ol
CID 64796310
1-(cyclopentylmethyl)-3,4-dihydro-2H-quinoline
CID 82078705
4-(2,3-dihydroindol-1-yl)-2-methyl-2-(propylamino)butan-1-ol
CID 64796687
2-cyclopropyl-3-(2,3-dihydroindol-1-yl)-2-(ethylamino)propanenitrile
CID 63913717
1-(2-cyclohexylethyl)-3,4-dihydro-2H-quinoline
CID 154337689
1-(3,4-dihydro-2H-quinolin-1-yl)-N,2-dimethylpropan-2-amine
CID 62846942
1-(2,3-dihydroindol-1-yl)-N-ethyl-2-methylpropan-2-amine
CID 62834088
methyl 3-(3,4-dihydro-2H-quinolin-1-yl)-2,2-dimethylpropanoate
CID 79624325
2-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)ethanol
CID 15488047
2-cyclopropyl-3-(6-fluoro-2,3-dihydroindol-1-yl)-2-(methylamino)propan-1-ol
CID 103503991
1-heptyl-3,4-dihydro-2H-quinoline
CID 154324891
5-(3,4-dihydro-2H-quinolin-1-yl)pentan-1-ol
CID 13472126

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-3-(3,4-dihydro-2H-quinolin-1-yl)-2-(propylamino)propan-1-ol?
The IUPAC name of 2-cyclopropyl-3-(3,4-dihydro-2H-quinolin-1-yl)-2-(propylamino)propan-1-ol (CID 64798243) is 2-cyclopropyl-3-(3,4-dihydro-2H-quinolin-1-yl)-2-(propylamino)propan-1-ol.
What is the SMILES notation for 2-cyclopropyl-3-(3,4-dihydro-2H-quinolin-1-yl)-2-(propylamino)propan-1-ol?
The canonical SMILES for 2-cyclopropyl-3-(3,4-dihydro-2H-quinolin-1-yl)-2-(propylamino)propan-1-ol is CCCNC(CO)(CN1CCCc2ccccc21)C1CC1.
What is the InChIKey of 2-cyclopropyl-3-(3,4-dihydro-2H-quinolin-1-yl)-2-(propylamino)propan-1-ol?
The InChIKey is NIJJIFKCMQPXTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O/c1-2-11-19-18(14-21,16-9-10-16)13-20-12-5-7-15-6-3-4-8-17(15)20/h3-4,6,8,16,19,21H,2,5,7,9-14H2,1H3.
What are the key properties of 2-cyclopropyl-3-(3,4-dihydro-2H-quinolin-1-yl)-2-(propylamino)propan-1-ol?
2-cyclopropyl-3-(3,4-dihydro-2H-quinolin-1-yl)-2-(propylamino)propan-1-ol has a molecular weight of 288.44 g/mol, XLogP of 2.58, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-3-(3,4-dihydro-2H-quinolin-1-yl)-2-(propylamino)propan-1-ol is sourced from PubChem (CID 64798243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).