1-[2-(3,5-dimethylpiperidin-1-yl)quinolin-3-yl]-N-methylmethanamine

C18H25N3 — CID 43281052

IUPAC1-[2-(3,5-dimethylpiperidin-1-yl)quinolin-3-yl]-N-methylmethanamine
SMILESCNCc1cc2ccccc2nc1N1CC(C)CC(C)C1
InChIInChI=1S/C18H25N3/c1-13-8-14(2)12-21(11-13)18-16(10-19-3)9-15-6-4-5-7-17(15)20-18/h4-7,9,13-14,19H,8,10-12H2,1-3H3
InChIKeyIIHMGIBHOQUNLB-UHFFFAOYSA-N
MW283.42 g/mol
LogP3.44
Rot. Bonds3

About 1-[2-(3,5-dimethylpiperidin-1-yl)quinolin-3-yl]-N-methylmethanamine

1-[2-(3,5-dimethylpiperidin-1-yl)quinolin-3-yl]-N-methylmethanamine (PubChem CID 43281052) has the molecular formula C18H25N3 and a molecular weight of 283.42 g/mol. Its IUPAC name is 1-[2-(3,5-dimethylpiperidin-1-yl)quinolin-3-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[2-(3,5-dimethylpiperidin-1-yl)quinolin-3-yl]-N-methylmethanamine
PubChem CID43281052
Molecular FormulaC18H25N3
Molecular Weight283.42 g/mol
Exact Mass283.20
IUPAC Name1-[2-(3,5-dimethylpiperidin-1-yl)quinolin-3-yl]-N-methylmethanamine
SMILESCNCc1cc2ccccc2nc1N1CC(C)CC(C)C1
InChIInChI=1S/C18H25N3/c1-13-8-14(2)12-21(11-13)18-16(10-19-3)9-15-6-4-5-7-17(15)20-18/h4-7,9,13-14,19H,8,10-12H2,1-3H3
InChIKeyIIHMGIBHOQUNLB-UHFFFAOYSA-N
XLogP3.44
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)quinolin-3-yl]-N-methylmethanamine
CID 115560704
N-methyl-1-(2-piperidin-1-ylquinolin-3-yl)methanamine
CID 43281139
1-[2-(azocan-1-yl)quinolin-3-yl]-N-methylmethanamine
CID 43281388
1-[3-(methylaminomethyl)quinolin-2-yl]piperidin-3-ol
CID 61434840
1-[1-[3-(methylaminomethyl)quinolin-2-yl]pyrrolidin-3-yl]ethanol
CID 115965646
N-methyl-1-[2-(2-methylpiperidin-1-yl)quinolin-3-yl]methanamine
CID 43280386
1-[1-(3,5-dimethylpiperidin-1-yl)isoquinolin-4-yl]-N-methylmethanamine
CID 106774888
3-(chloromethyl)-2-(3,4,5-trimethylpiperazin-1-yl)quinoline
CID 114538478
1-[2-(3,5-dimethylpyrazol-1-yl)quinolin-3-yl]-N-methylmethanamine
CID 43282141
3-(bromomethyl)-2-(2,3,5-trimethylpiperidin-1-yl)quinoline
CID 107085362
1-[2-(4-bromo-3,5-dimethylpyrazol-1-yl)quinolin-3-yl]-N-methylmethanamine
CID 62128738
1-[3-[(propan-2-ylamino)methyl]quinolin-2-yl]pyrrolidin-3-ol
CID 62941726

Frequently Asked Questions

What is the IUPAC name of 1-[2-(3,5-dimethylpiperidin-1-yl)quinolin-3-yl]-N-methylmethanamine?
The IUPAC name of 1-[2-(3,5-dimethylpiperidin-1-yl)quinolin-3-yl]-N-methylmethanamine (CID 43281052) is 1-[2-(3,5-dimethylpiperidin-1-yl)quinolin-3-yl]-N-methylmethanamine.
What is the SMILES notation for 1-[2-(3,5-dimethylpiperidin-1-yl)quinolin-3-yl]-N-methylmethanamine?
The canonical SMILES for 1-[2-(3,5-dimethylpiperidin-1-yl)quinolin-3-yl]-N-methylmethanamine is CNCc1cc2ccccc2nc1N1CC(C)CC(C)C1.
What is the InChIKey of 1-[2-(3,5-dimethylpiperidin-1-yl)quinolin-3-yl]-N-methylmethanamine?
The InChIKey is IIHMGIBHOQUNLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3/c1-13-8-14(2)12-21(11-13)18-16(10-19-3)9-15-6-4-5-7-17(15)20-18/h4-7,9,13-14,19H,8,10-12H2,1-3H3.
What are the key properties of 1-[2-(3,5-dimethylpiperidin-1-yl)quinolin-3-yl]-N-methylmethanamine?
1-[2-(3,5-dimethylpiperidin-1-yl)quinolin-3-yl]-N-methylmethanamine has a molecular weight of 283.42 g/mol, XLogP of 3.44, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(3,5-dimethylpiperidin-1-yl)quinolin-3-yl]-N-methylmethanamine is sourced from PubChem (CID 43281052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).