6-(2-piperidin-4-ylethyl)-1,2,3,4-tetrahydroquinoline

C16H24N2 — CID 116997911

IUPAC6-(2-piperidin-4-ylethyl)-1,2,3,4-tetrahydroquinoline
SMILESc1cc2c(cc1CCC1CCNCC1)CCCN2
InChIInChI=1S/C16H24N2/c1-2-15-12-14(5-6-16(15)18-9-1)4-3-13-7-10-17-11-8-13/h5-6,12-13,17-18H,1-4,7-11H2
InChIKeyIMAQTIIUDBLBQI-UHFFFAOYSA-N
MW244.38 g/mol
LogP2.98
Rot. Bonds3

About 6-(2-piperidin-4-ylethyl)-1,2,3,4-tetrahydroquinoline

6-(2-piperidin-4-ylethyl)-1,2,3,4-tetrahydroquinoline (PubChem CID 116997911) has the molecular formula C16H24N2 and a molecular weight of 244.38 g/mol. Its IUPAC name is 6-(2-piperidin-4-ylethyl)-1,2,3,4-tetrahydroquinoline.

Molecular Properties

Compound Name6-(2-piperidin-4-ylethyl)-1,2,3,4-tetrahydroquinoline
PubChem CID116997911
Molecular FormulaC16H24N2
Molecular Weight244.38 g/mol
Exact Mass244.19
IUPAC Name6-(2-piperidin-4-ylethyl)-1,2,3,4-tetrahydroquinoline
SMILESc1cc2c(cc1CCC1CCNCC1)CCCN2
InChIInChI=1S/C16H24N2/c1-2-15-12-14(5-6-16(15)18-9-1)4-3-13-7-10-17-11-8-13/h5-6,12-13,17-18H,1-4,7-11H2
InChIKeyIMAQTIIUDBLBQI-UHFFFAOYSA-N
XLogP2.98
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.38
LogP ≤ 52.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-(2-piperidin-4-ylethyl)-2,3-dihydro-1H-indole
CID 116998012
6-(2-cyclohexylethyl)-1,2,3,4-tetrahydroquinoline
CID 114192887
6-(2-piperidin-4-ylethyl)-3,4-dihydro-1H-quinolin-2-one
CID 116925681
6-(3,3-dimethylbutyl)-1,2,3,4-tetrahydroquinoline
CID 106778864
6-(cyclobutylmethyl)-1,2,3,4-tetrahydroquinoline
CID 106779249
4-[2-(3,4-dihydro-2H-chromen-6-yl)ethyl]piperidine
CID 116925700
N-[2-(1,2,3,4-tetrahydroquinolin-6-yl)ethyl]cyclopropanamine
CID 82256847
1-methyl-6-(2-piperidin-4-ylethyl)-3,4-dihydro-2H-quinoline
CID 62095616
6-[2-(4-methylphenyl)ethyl]-1,2,3,4-tetrahydroquinoline
CID 63968254
N-[2-(1,2,3,4-tetrahydroquinolin-6-yl)ethyl]cycloheptanamine
CID 82256808
6-[2-(2,4,6-trimethylphenyl)ethyl]-1,2,3,4-tetrahydroquinoline
CID 63968458
4-(2-naphthalen-2-ylethyl)piperidine
CID 43146715

Frequently Asked Questions

What is the IUPAC name of 6-(2-piperidin-4-ylethyl)-1,2,3,4-tetrahydroquinoline?
The IUPAC name of 6-(2-piperidin-4-ylethyl)-1,2,3,4-tetrahydroquinoline (CID 116997911) is 6-(2-piperidin-4-ylethyl)-1,2,3,4-tetrahydroquinoline.
What is the SMILES notation for 6-(2-piperidin-4-ylethyl)-1,2,3,4-tetrahydroquinoline?
The canonical SMILES for 6-(2-piperidin-4-ylethyl)-1,2,3,4-tetrahydroquinoline is c1cc2c(cc1CCC1CCNCC1)CCCN2.
What is the InChIKey of 6-(2-piperidin-4-ylethyl)-1,2,3,4-tetrahydroquinoline?
The InChIKey is IMAQTIIUDBLBQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2/c1-2-15-12-14(5-6-16(15)18-9-1)4-3-13-7-10-17-11-8-13/h5-6,12-13,17-18H,1-4,7-11H2.
What are the key properties of 6-(2-piperidin-4-ylethyl)-1,2,3,4-tetrahydroquinoline?
6-(2-piperidin-4-ylethyl)-1,2,3,4-tetrahydroquinoline has a molecular weight of 244.38 g/mol, XLogP of 2.98, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-piperidin-4-ylethyl)-1,2,3,4-tetrahydroquinoline is sourced from PubChem (CID 116997911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).