3-methyl-6-(piperidin-3-ylmethyl)quinoline

C16H20N2 — CID 116997414

IUPAC3-methyl-6-(piperidin-3-ylmethyl)quinoline
SMILESCc1cnc2ccc(CC3CCCNC3)cc2c1
InChIInChI=1S/C16H20N2/c1-12-7-15-9-13(4-5-16(15)18-10-12)8-14-3-2-6-17-11-14/h4-5,7,9-10,14,17H,2-3,6,8,11H2,1H3
InChIKeyOMCCNIBTGCRGMW-UHFFFAOYSA-N
MW240.35 g/mol
LogP3.09
Rot. Bonds2

About 3-methyl-6-(piperidin-3-ylmethyl)quinoline

3-methyl-6-(piperidin-3-ylmethyl)quinoline (PubChem CID 116997414) has the molecular formula C16H20N2 and a molecular weight of 240.35 g/mol. Its IUPAC name is 3-methyl-6-(piperidin-3-ylmethyl)quinoline.

Molecular Properties

Compound Name3-methyl-6-(piperidin-3-ylmethyl)quinoline
PubChem CID116997414
Molecular FormulaC16H20N2
Molecular Weight240.35 g/mol
Exact Mass240.16
IUPAC Name3-methyl-6-(piperidin-3-ylmethyl)quinoline
SMILESCc1cnc2ccc(CC3CCCNC3)cc2c1
InChIInChI=1S/C16H20N2/c1-12-7-15-9-13(4-5-16(15)18-10-12)8-14-3-2-6-17-11-14/h4-5,7,9-10,14,17H,2-3,6,8,11H2,1H3
InChIKeyOMCCNIBTGCRGMW-UHFFFAOYSA-N
XLogP3.09
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-methyl-6-(piperidin-3-ylmethyl)quinoline 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-methyl-6-(piperidin-4-ylmethyl)quinoline
CID 116997415
2-methyl-4-[[(3R)-piperidin-3-yl]methyl]pyridine
CID 139490801
3-[(3-methylphenyl)methyl]piperidine
CID 17039519
(3S)-3-[(3-methylphenyl)methyl]piperidine
CID 39345685
5,7-dimethyl-3-(piperidin-3-ylmethyl)quinoline
CID 84635397
7-(piperidin-3-ylmethyl)quinoline
CID 84791058
6-(azepan-4-ylmethyl)quinoline
CID 155906957
6-methyl-2-(piperidin-3-ylmethyl)-1H-imidazo[4,5-b]pyridine
CID 79796036
2-cyclopropyl-6-(piperidin-3-ylmethyl)-1H-benzimidazole
CID 117391858
6-(piperidin-3-ylmethyl)-1,3-benzothiazol-2-amine
CID 116994108
3-[(3-ethyl-4-methylphenyl)methyl]piperidine
CID 84785651
2-methyl-6-(pyrrolidin-3-ylmethyl)-1,3-benzothiazole
CID 84795648

Frequently Asked Questions

What is the IUPAC name of 3-methyl-6-(piperidin-3-ylmethyl)quinoline?
The IUPAC name of 3-methyl-6-(piperidin-3-ylmethyl)quinoline (CID 116997414) is 3-methyl-6-(piperidin-3-ylmethyl)quinoline.
What is the SMILES notation for 3-methyl-6-(piperidin-3-ylmethyl)quinoline?
The canonical SMILES for 3-methyl-6-(piperidin-3-ylmethyl)quinoline is Cc1cnc2ccc(CC3CCCNC3)cc2c1.
What is the InChIKey of 3-methyl-6-(piperidin-3-ylmethyl)quinoline?
The InChIKey is OMCCNIBTGCRGMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2/c1-12-7-15-9-13(4-5-16(15)18-10-12)8-14-3-2-6-17-11-14/h4-5,7,9-10,14,17H,2-3,6,8,11H2,1H3.
What are the key properties of 3-methyl-6-(piperidin-3-ylmethyl)quinoline?
3-methyl-6-(piperidin-3-ylmethyl)quinoline has a molecular weight of 240.35 g/mol, XLogP of 3.09, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-6-(piperidin-3-ylmethyl)quinoline is sourced from PubChem (CID 116997414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).