1-[2-(4-methylpiperidin-1-yl)ethyl]-3,4-dihydro-2H-quinoline

C17H26N2 — CID 54807289

IUPAC1-[2-(4-methylpiperidin-1-yl)ethyl]-3,4-dihydro-2H-quinoline
SMILESCC1CCN(CCN2CCCc3ccccc32)CC1
InChIInChI=1S/C17H26N2/c1-15-8-11-18(12-9-15)13-14-19-10-4-6-16-5-2-3-7-17(16)19/h2-3,5,7,15H,4,6,8-14H2,1H3
InChIKeyRHMPQLNUKGQJHL-UHFFFAOYSA-N
MW258.41 g/mol
LogP3.17
Rot. Bonds3

About 1-[2-(4-methylpiperidin-1-yl)ethyl]-3,4-dihydro-2H-quinoline

1-[2-(4-methylpiperidin-1-yl)ethyl]-3,4-dihydro-2H-quinoline (PubChem CID 54807289) has the molecular formula C17H26N2 and a molecular weight of 258.41 g/mol. Its IUPAC name is 1-[2-(4-methylpiperidin-1-yl)ethyl]-3,4-dihydro-2H-quinoline.

Molecular Properties

Compound Name1-[2-(4-methylpiperidin-1-yl)ethyl]-3,4-dihydro-2H-quinoline
PubChem CID54807289
Molecular FormulaC17H26N2
Molecular Weight258.41 g/mol
Exact Mass258.21
IUPAC Name1-[2-(4-methylpiperidin-1-yl)ethyl]-3,4-dihydro-2H-quinoline
SMILESCC1CCN(CCN2CCCc3ccccc32)CC1
InChIInChI=1S/C17H26N2/c1-15-8-11-18(12-9-15)13-14-19-10-4-6-16-5-2-3-7-17(16)19/h2-3,5,7,15H,4,6,8-14H2,1H3
InChIKeyRHMPQLNUKGQJHL-UHFFFAOYSA-N
XLogP3.17
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.41
LogP ≤ 53.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-pyrrolidin-1-ylethyl)-3,4-dihydro-2H-quinoline
CID 59807075
1-[1-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]piperidin-4-yl]imidazolidin-2-one
CID 75434932
1-(3-pyrrolidin-1-ylpropyl)-3,4-dihydro-2H-quinoline
CID 82085595
2-(3,4-dihydro-2H-quinolin-1-yl)-1-(4-methylpiperidin-1-yl)ethanone
CID 54816851
1-[2-(azepan-1-yl)ethyl]-2,3-dihydroindole
CID 54806650
[(3R)-1-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]piperidin-3-yl]methanol
CID 99108244
2-[[1-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]piperidin-4-yl]methyl]-3H-isoindol-1-one
CID 21077961
1-(2-cyclohexylethyl)-3,4-dihydro-2H-quinoline
CID 154337689
4-(3,4-dihydro-2H-quinolin-1-yl)-2-methylbutan-2-ol
CID 79316472
4-[2-(4-methylpiperidin-1-yl)ethyl]-2,3-dihydro-1H-quinoxaline
CID 28796776
1-heptyl-3,4-dihydro-2H-quinoline
CID 154324891
1-(4-piperazin-1-ylbutyl)-3,4-dihydro-2H-quinoline
CID 28808284

Frequently Asked Questions

What is the IUPAC name of 1-[2-(4-methylpiperidin-1-yl)ethyl]-3,4-dihydro-2H-quinoline?
The IUPAC name of 1-[2-(4-methylpiperidin-1-yl)ethyl]-3,4-dihydro-2H-quinoline (CID 54807289) is 1-[2-(4-methylpiperidin-1-yl)ethyl]-3,4-dihydro-2H-quinoline.
What is the SMILES notation for 1-[2-(4-methylpiperidin-1-yl)ethyl]-3,4-dihydro-2H-quinoline?
The canonical SMILES for 1-[2-(4-methylpiperidin-1-yl)ethyl]-3,4-dihydro-2H-quinoline is CC1CCN(CCN2CCCc3ccccc32)CC1.
What is the InChIKey of 1-[2-(4-methylpiperidin-1-yl)ethyl]-3,4-dihydro-2H-quinoline?
The InChIKey is RHMPQLNUKGQJHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2/c1-15-8-11-18(12-9-15)13-14-19-10-4-6-16-5-2-3-7-17(16)19/h2-3,5,7,15H,4,6,8-14H2,1H3.
What are the key properties of 1-[2-(4-methylpiperidin-1-yl)ethyl]-3,4-dihydro-2H-quinoline?
1-[2-(4-methylpiperidin-1-yl)ethyl]-3,4-dihydro-2H-quinoline has a molecular weight of 258.41 g/mol, XLogP of 3.17, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(4-methylpiperidin-1-yl)ethyl]-3,4-dihydro-2H-quinoline is sourced from PubChem (CID 54807289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).