[3-(methoxymethyl)piperidin-1-yl]-(1,2,3,4-tetrahydroquinolin-6-yl)methanone

C17H24N2O2 — CID 106586843

IUPAC[3-(methoxymethyl)piperidin-1-yl]-(1,2,3,4-tetrahydroquinolin-6-yl)methanone
SMILESCOCC1CCCN(C(=O)c2ccc3c(c2)CCCN3)C1
InChIInChI=1S/C17H24N2O2/c1-21-12-13-4-3-9-19(11-13)17(20)15-6-7-16-14(10-15)5-2-8-18-16/h6-7,10,13,18H,2-5,8-9,11-12H2,1H3
InChIKeyNHPFHQRVGOTUSX-UHFFFAOYSA-N
MW288.39 g/mol
LogP2.54
Rot. Bonds3

About [3-(methoxymethyl)piperidin-1-yl]-(1,2,3,4-tetrahydroquinolin-6-yl)methanone

[3-(methoxymethyl)piperidin-1-yl]-(1,2,3,4-tetrahydroquinolin-6-yl)methanone (PubChem CID 106586843) has the molecular formula C17H24N2O2 and a molecular weight of 288.39 g/mol. Its IUPAC name is [3-(methoxymethyl)piperidin-1-yl]-(1,2,3,4-tetrahydroquinolin-6-yl)methanone.

Molecular Properties

Compound Name[3-(methoxymethyl)piperidin-1-yl]-(1,2,3,4-tetrahydroquinolin-6-yl)methanone
PubChem CID106586843
Molecular FormulaC17H24N2O2
Molecular Weight288.39 g/mol
Exact Mass288.18
IUPAC Name[3-(methoxymethyl)piperidin-1-yl]-(1,2,3,4-tetrahydroquinolin-6-yl)methanone
SMILESCOCC1CCCN(C(=O)c2ccc3c(c2)CCCN3)C1
InChIInChI=1S/C17H24N2O2/c1-21-12-13-4-3-9-19(11-13)17(20)15-6-7-16-14(10-15)5-2-8-18-16/h6-7,10,13,18H,2-5,8-9,11-12H2,1H3
InChIKeyNHPFHQRVGOTUSX-UHFFFAOYSA-N
XLogP2.54
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [3-(methoxymethyl)piperidin-1-yl]-(1,2,3,4-tetrahydroquinolin-6-yl)methanone with MolForge

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Related Compounds

(3-methoxypyrrolidin-1-yl)-(1,2,3,4-tetrahydroquinolin-6-yl)methanone
CID 103533020
[4-(methoxymethyl)-3,6-dihydro-2H-pyridin-1-yl]-(1,2,3,4-tetrahydroquinolin-6-yl)methanone
CID 114409872
(3-amino-4-methoxyphenyl)-[3-(methoxymethyl)piperidin-1-yl]methanone
CID 106585621
[3-(methoxymethyl)piperidin-1-yl]-(4-methylphenyl)methanone
CID 90504931
1H-indol-6-yl-[(3R)-3-(methoxymethyl)piperidin-1-yl]methanone
CID 94658936
1H-indol-6-yl-[3-(methoxymethyl)piperidin-1-yl]methanone
CID 56724316
[4-(2-methoxyethyl)-3-propylpiperazin-1-yl]-(1,2,3,4-tetrahydroquinolin-6-yl)methanone
CID 138045601
(4-bromo-3-methylphenyl)-[3-(methoxymethyl)piperidin-1-yl]methanone
CID 113339183
N-[1-(2,3-dihydro-1H-indole-5-carbonyl)piperidin-3-yl]acetamide
CID 60947810
(4-bromo-3-chlorophenyl)-[3-(methoxymethyl)piperidin-1-yl]methanone
CID 113259178
(3-bromo-4-chlorophenyl)-[3-(methoxymethyl)piperidin-1-yl]methanone
CID 103841992
3-[3-(methoxymethyl)piperidine-1-carbonyl]benzonitrile
CID 90504865

Frequently Asked Questions

What is the IUPAC name of [3-(methoxymethyl)piperidin-1-yl]-(1,2,3,4-tetrahydroquinolin-6-yl)methanone?
The IUPAC name of [3-(methoxymethyl)piperidin-1-yl]-(1,2,3,4-tetrahydroquinolin-6-yl)methanone (CID 106586843) is [3-(methoxymethyl)piperidin-1-yl]-(1,2,3,4-tetrahydroquinolin-6-yl)methanone.
What is the SMILES notation for [3-(methoxymethyl)piperidin-1-yl]-(1,2,3,4-tetrahydroquinolin-6-yl)methanone?
The canonical SMILES for [3-(methoxymethyl)piperidin-1-yl]-(1,2,3,4-tetrahydroquinolin-6-yl)methanone is COCC1CCCN(C(=O)c2ccc3c(c2)CCCN3)C1.
What is the InChIKey of [3-(methoxymethyl)piperidin-1-yl]-(1,2,3,4-tetrahydroquinolin-6-yl)methanone?
The InChIKey is NHPFHQRVGOTUSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O2/c1-21-12-13-4-3-9-19(11-13)17(20)15-6-7-16-14(10-15)5-2-8-18-16/h6-7,10,13,18H,2-5,8-9,11-12H2,1H3.
What are the key properties of [3-(methoxymethyl)piperidin-1-yl]-(1,2,3,4-tetrahydroquinolin-6-yl)methanone?
[3-(methoxymethyl)piperidin-1-yl]-(1,2,3,4-tetrahydroquinolin-6-yl)methanone has a molecular weight of 288.39 g/mol, XLogP of 2.54, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(methoxymethyl)piperidin-1-yl]-(1,2,3,4-tetrahydroquinolin-6-yl)methanone is sourced from PubChem (CID 106586843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).