7-[(1,3-dimethylpiperidin-3-yl)methoxy]-1,2,3,4-tetrahydroquinoline

C17H26N2O — CID 115075538

IUPAC7-[(1,3-dimethylpiperidin-3-yl)methoxy]-1,2,3,4-tetrahydroquinoline
SMILESCN1CCCC(C)(COc2ccc3c(c2)NCCC3)C1
InChIInChI=1S/C17H26N2O/c1-17(8-4-10-19(2)12-17)13-20-15-7-6-14-5-3-9-18-16(14)11-15/h6-7,11,18H,3-5,8-10,12-13H2,1-2H3
InChIKeyRFENCRQVRFIKMX-UHFFFAOYSA-N
MW274.41 g/mol
LogP3.16
Rot. Bonds3

About 7-[(1,3-dimethylpiperidin-3-yl)methoxy]-1,2,3,4-tetrahydroquinoline

7-[(1,3-dimethylpiperidin-3-yl)methoxy]-1,2,3,4-tetrahydroquinoline (PubChem CID 115075538) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is 7-[(1,3-dimethylpiperidin-3-yl)methoxy]-1,2,3,4-tetrahydroquinoline.

Molecular Properties

Compound Name7-[(1,3-dimethylpiperidin-3-yl)methoxy]-1,2,3,4-tetrahydroquinoline
PubChem CID115075538
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC Name7-[(1,3-dimethylpiperidin-3-yl)methoxy]-1,2,3,4-tetrahydroquinoline
SMILESCN1CCCC(C)(COc2ccc3c(c2)NCCC3)C1
InChIInChI=1S/C17H26N2O/c1-17(8-4-10-19(2)12-17)13-20-15-7-6-14-5-3-9-18-16(14)11-15/h6-7,11,18H,3-5,8-10,12-13H2,1-2H3
InChIKeyRFENCRQVRFIKMX-UHFFFAOYSA-N
XLogP3.16
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

7-[(1,3-dimethylazetidin-3-yl)methoxy]-1,2,3,4-tetrahydroquinoline
CID 115075463
7-[(3-methyl-1-propan-2-ylpiperidin-3-yl)methoxy]-1,2,3,4-tetrahydroquinoline
CID 115075542
7-[(1,4-dimethylcyclohexyl)methoxy]-1,2,3,4-tetrahydroquinoline
CID 115075481
6-[(1-ethyl-3-methylpyrrolidin-3-yl)methoxy]-2,3-dihydro-1H-indole
CID 115074784
8-[(1,3-dimethylpiperidin-3-yl)methoxy]-1,2,3,4-tetrahydroquinoline
CID 115075708
7-(1,4-dimethylpiperidin-4-yl)oxy-1,2,3,4-tetrahydroquinoline
CID 115075422
6-[(4-methylpiperidin-4-yl)methoxy]-2,3-dihydro-1H-indole
CID 115074794
6-[(1-ethyl-3-methylazetidin-3-yl)methoxy]-1,2,3,4-tetrahydroquinoline
CID 115075288
6-[(3-methylthiolan-3-yl)methoxy]-2,3-dihydro-1H-indole
CID 115074777
4-methyl-4-(1,2,3,4-tetrahydroquinolin-6-yloxymethyl)thiane 1,1-dioxide
CID 115075339
3-methyl-3-(1,2,3,4-tetrahydroquinolin-6-yloxymethyl)thiane 1,1-dioxide
CID 115075355
7-butoxy-1,2,3,4-tetrahydroquinoline
CID 107313953

Frequently Asked Questions

What is the IUPAC name of 7-[(1,3-dimethylpiperidin-3-yl)methoxy]-1,2,3,4-tetrahydroquinoline?
The IUPAC name of 7-[(1,3-dimethylpiperidin-3-yl)methoxy]-1,2,3,4-tetrahydroquinoline (CID 115075538) is 7-[(1,3-dimethylpiperidin-3-yl)methoxy]-1,2,3,4-tetrahydroquinoline.
What is the SMILES notation for 7-[(1,3-dimethylpiperidin-3-yl)methoxy]-1,2,3,4-tetrahydroquinoline?
The canonical SMILES for 7-[(1,3-dimethylpiperidin-3-yl)methoxy]-1,2,3,4-tetrahydroquinoline is CN1CCCC(C)(COc2ccc3c(c2)NCCC3)C1.
What is the InChIKey of 7-[(1,3-dimethylpiperidin-3-yl)methoxy]-1,2,3,4-tetrahydroquinoline?
The InChIKey is RFENCRQVRFIKMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-17(8-4-10-19(2)12-17)13-20-15-7-6-14-5-3-9-18-16(14)11-15/h6-7,11,18H,3-5,8-10,12-13H2,1-2H3.
What are the key properties of 7-[(1,3-dimethylpiperidin-3-yl)methoxy]-1,2,3,4-tetrahydroquinoline?
7-[(1,3-dimethylpiperidin-3-yl)methoxy]-1,2,3,4-tetrahydroquinoline has a molecular weight of 274.41 g/mol, XLogP of 3.16, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[(1,3-dimethylpiperidin-3-yl)methoxy]-1,2,3,4-tetrahydroquinoline is sourced from PubChem (CID 115075538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).