8-[(1-ethylpiperidin-4-yl)methoxy]-1,2,3,4-tetrahydroquinoline

C17H26N2O — CID 115075693

IUPAC8-[(1-ethylpiperidin-4-yl)methoxy]-1,2,3,4-tetrahydroquinoline
SMILESCCN1CCC(COc2cccc3c2NCCC3)CC1
InChIInChI=1S/C17H26N2O/c1-2-19-11-8-14(9-12-19)13-20-16-7-3-5-15-6-4-10-18-17(15)16/h3,5,7,14,18H,2,4,6,8-13H2,1H3
InChIKeyRNMQQTVWGQXRHQ-UHFFFAOYSA-N
MW274.41 g/mol
LogP3.16
Rot. Bonds4

About 8-[(1-ethylpiperidin-4-yl)methoxy]-1,2,3,4-tetrahydroquinoline

8-[(1-ethylpiperidin-4-yl)methoxy]-1,2,3,4-tetrahydroquinoline (PubChem CID 115075693) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is 8-[(1-ethylpiperidin-4-yl)methoxy]-1,2,3,4-tetrahydroquinoline.

Molecular Properties

Compound Name8-[(1-ethylpiperidin-4-yl)methoxy]-1,2,3,4-tetrahydroquinoline
PubChem CID115075693
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC Name8-[(1-ethylpiperidin-4-yl)methoxy]-1,2,3,4-tetrahydroquinoline
SMILESCCN1CCC(COc2cccc3c2NCCC3)CC1
InChIInChI=1S/C17H26N2O/c1-2-19-11-8-14(9-12-19)13-20-16-7-3-5-15-6-4-10-18-17(15)16/h3,5,7,14,18H,2,4,6,8-13H2,1H3
InChIKeyRNMQQTVWGQXRHQ-UHFFFAOYSA-N
XLogP3.16
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
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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Frequently Asked Questions

What is the IUPAC name of 8-[(1-ethylpiperidin-4-yl)methoxy]-1,2,3,4-tetrahydroquinoline?
The IUPAC name of 8-[(1-ethylpiperidin-4-yl)methoxy]-1,2,3,4-tetrahydroquinoline (CID 115075693) is 8-[(1-ethylpiperidin-4-yl)methoxy]-1,2,3,4-tetrahydroquinoline.
What is the SMILES notation for 8-[(1-ethylpiperidin-4-yl)methoxy]-1,2,3,4-tetrahydroquinoline?
The canonical SMILES for 8-[(1-ethylpiperidin-4-yl)methoxy]-1,2,3,4-tetrahydroquinoline is CCN1CCC(COc2cccc3c2NCCC3)CC1.
What is the InChIKey of 8-[(1-ethylpiperidin-4-yl)methoxy]-1,2,3,4-tetrahydroquinoline?
The InChIKey is RNMQQTVWGQXRHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-2-19-11-8-14(9-12-19)13-20-16-7-3-5-15-6-4-10-18-17(15)16/h3,5,7,14,18H,2,4,6,8-13H2,1H3.
What are the key properties of 8-[(1-ethylpiperidin-4-yl)methoxy]-1,2,3,4-tetrahydroquinoline?
8-[(1-ethylpiperidin-4-yl)methoxy]-1,2,3,4-tetrahydroquinoline has a molecular weight of 274.41 g/mol, XLogP of 3.16, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[(1-ethylpiperidin-4-yl)methoxy]-1,2,3,4-tetrahydroquinoline is sourced from PubChem (CID 115075693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).