(4-methylpiperidin-1-yl)-[6-(3-piperidin-3-ylpropoxy)quinolin-2-yl]methanone

C24H33N3O2 — CID 67012303

IUPAC(4-methylpiperidin-1-yl)-[6-(3-piperidin-3-ylpropoxy)quinolin-2-yl]methanone
SMILESCC1CCN(C(=O)c2ccc3cc(OCCCC4CCCNC4)ccc3n2)CC1
InChIInChI=1S/C24H33N3O2/c1-18-10-13-27(14-11-18)24(28)23-8-6-20-16-21(7-9-22(20)26-23)29-15-3-5-19-4-2-12-25-17-19/h6-9,16,18-19,25H,2-5,10-15,17H2,1H3
InChIKeyBYGHMTHHGXGQAC-UHFFFAOYSA-N
MW395.55 g/mol
LogP4.27
Rot. Bonds6

About (4-methylpiperidin-1-yl)-[6-(3-piperidin-3-ylpropoxy)quinolin-2-yl]methanone

(4-methylpiperidin-1-yl)-[6-(3-piperidin-3-ylpropoxy)quinolin-2-yl]methanone (PubChem CID 67012303) has the molecular formula C24H33N3O2 and a molecular weight of 395.55 g/mol. Its IUPAC name is (4-methylpiperidin-1-yl)-[6-(3-piperidin-3-ylpropoxy)quinolin-2-yl]methanone.

Molecular Properties

Compound Name(4-methylpiperidin-1-yl)-[6-(3-piperidin-3-ylpropoxy)quinolin-2-yl]methanone
PubChem CID67012303
Molecular FormulaC24H33N3O2
Molecular Weight395.55 g/mol
Exact Mass395.26
IUPAC Name(4-methylpiperidin-1-yl)-[6-(3-piperidin-3-ylpropoxy)quinolin-2-yl]methanone
SMILESCC1CCN(C(=O)c2ccc3cc(OCCCC4CCCNC4)ccc3n2)CC1
InChIInChI=1S/C24H33N3O2/c1-18-10-13-27(14-11-18)24(28)23-8-6-20-16-21(7-9-22(20)26-23)29-15-3-5-19-4-2-12-25-17-19/h6-9,16,18-19,25H,2-5,10-15,17H2,1H3
InChIKeyBYGHMTHHGXGQAC-UHFFFAOYSA-N
XLogP4.27
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.55
LogP ≤ 54.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze (4-methylpiperidin-1-yl)-[6-(3-piperidin-3-ylpropoxy)quinolin-2-yl]methanone 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

3,6-dihydro-2H-pyridin-1-yl-[6-(3-piperidin-3-ylpropoxy)quinolin-2-yl]methanone
CID 67011523
(4-methylpiperazin-1-yl)-[6-(3-piperidin-3-ylpropoxy)naphthalen-2-yl]methanone
CID 69490917
[3-(dimethylamino)pyrrolidin-1-yl]-[6-(3-piperidin-3-ylpropoxy)naphthalen-2-yl]methanone
CID 69490968
(4-methylpiperidin-1-yl)-[4-[[(3R)-piperidin-3-yl]methoxy]phenyl]methanone
CID 95169844
N-cyclobutyl-6-(3-piperidin-3-ylpropoxy)naphthalene-2-carboxamide
CID 69489101
(6-fluoroquinolin-2-yl)-(4-methylpiperidin-1-yl)methanone
CID 110464452
[3-(3-piperidin-3-ylpropoxy)phenyl] acetate
CID 67740923
(4-methoxypiperidin-1-yl)-(6-methoxyquinolin-2-yl)methanone
CID 56810636
morpholin-4-yl-[6-(3-piperidin-1-ylpropoxy)quinolin-2-yl]methanone
CID 11516523
(1,1-dioxo-1,4-thiazinan-4-yl)-[6-(3-piperidin-1-ylpropoxy)quinolin-2-yl]methanone
CID 11539264
N-methyl-4-(2-piperidin-3-ylethoxy)pyridine-2-carboxamide
CID 62358035
(7-fluoroquinolin-2-yl)-(4-methylpiperidin-1-yl)methanone
CID 110485391

Frequently Asked Questions

What is the IUPAC name of (4-methylpiperidin-1-yl)-[6-(3-piperidin-3-ylpropoxy)quinolin-2-yl]methanone?
The IUPAC name of (4-methylpiperidin-1-yl)-[6-(3-piperidin-3-ylpropoxy)quinolin-2-yl]methanone (CID 67012303) is (4-methylpiperidin-1-yl)-[6-(3-piperidin-3-ylpropoxy)quinolin-2-yl]methanone.
What is the SMILES notation for (4-methylpiperidin-1-yl)-[6-(3-piperidin-3-ylpropoxy)quinolin-2-yl]methanone?
The canonical SMILES for (4-methylpiperidin-1-yl)-[6-(3-piperidin-3-ylpropoxy)quinolin-2-yl]methanone is CC1CCN(C(=O)c2ccc3cc(OCCCC4CCCNC4)ccc3n2)CC1.
What is the InChIKey of (4-methylpiperidin-1-yl)-[6-(3-piperidin-3-ylpropoxy)quinolin-2-yl]methanone?
The InChIKey is BYGHMTHHGXGQAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H33N3O2/c1-18-10-13-27(14-11-18)24(28)23-8-6-20-16-21(7-9-22(20)26-23)29-15-3-5-19-4-2-12-25-17-19/h6-9,16,18-19,25H,2-5,10-15,17H2,1H3.
What are the key properties of (4-methylpiperidin-1-yl)-[6-(3-piperidin-3-ylpropoxy)quinolin-2-yl]methanone?
(4-methylpiperidin-1-yl)-[6-(3-piperidin-3-ylpropoxy)quinolin-2-yl]methanone has a molecular weight of 395.55 g/mol, XLogP of 4.27, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methylpiperidin-1-yl)-[6-(3-piperidin-3-ylpropoxy)quinolin-2-yl]methanone is sourced from PubChem (CID 67012303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).