(3-ethoxypiperidin-1-yl)-quinoxalin-6-ylmethanone

C16H19N3O2 — CID 16734283

IUPAC(3-ethoxypiperidin-1-yl)-quinoxalin-6-ylmethanone
SMILESCCOC1CCCN(C(=O)c2ccc3nccnc3c2)C1
InChIInChI=1S/C16H19N3O2/c1-2-21-13-4-3-9-19(11-13)16(20)12-5-6-14-15(10-12)18-8-7-17-14/h5-8,10,13H,2-4,9,11H2,1H3
InChIKeySHLDLIAQMUJRKB-UHFFFAOYSA-N
MW285.35 g/mol
LogP2.27
Rot. Bonds3

About (3-ethoxypiperidin-1-yl)-quinoxalin-6-ylmethanone

(3-ethoxypiperidin-1-yl)-quinoxalin-6-ylmethanone (PubChem CID 16734283) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is (3-ethoxypiperidin-1-yl)-quinoxalin-6-ylmethanone.

Molecular Properties

Compound Name(3-ethoxypiperidin-1-yl)-quinoxalin-6-ylmethanone
PubChem CID16734283
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC Name(3-ethoxypiperidin-1-yl)-quinoxalin-6-ylmethanone
SMILESCCOC1CCCN(C(=O)c2ccc3nccnc3c2)C1
InChIInChI=1S/C16H19N3O2/c1-2-21-13-4-3-9-19(11-13)16(20)12-5-6-14-15(10-12)18-8-7-17-14/h5-8,10,13H,2-4,9,11H2,1H3
InChIKeySHLDLIAQMUJRKB-UHFFFAOYSA-N
XLogP2.27
TPSA55.32 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 52.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

[3-(4,6-dimethylpyrimidin-2-yl)oxypiperidin-1-yl]-quinoxalin-6-ylmethanone
CID 122257971
[3-(cyclopropylmethoxy)pyrrolidin-1-yl]-quinoxalin-6-ylmethanone
CID 121197527
(3-chloropiperidin-1-yl)-quinoxalin-6-ylmethanone
CID 55185515
[3-(5-chloropyrimidin-2-yl)oxypiperidin-1-yl]-quinoxalin-6-ylmethanone
CID 119100812
(3-chlorophenyl)-(3-ethoxypiperidin-1-yl)methanone
CID 42656405
[3-(2,6-dimethylpyrimidin-4-yl)oxypiperidin-1-yl]-quinoxalin-6-ylmethanone
CID 122260430
[3-(6-methoxypyrazin-2-yl)oxypiperidin-1-yl]-quinoxalin-6-ylmethanone
CID 91628208
(3,5-dihydroxyphenyl)-(3-ethoxypiperidin-1-yl)methanone
CID 103892247
[(3R)-3-ethoxypiperidin-1-yl]-[2-(1,2,4-triazol-1-yl)-4-pyridinyl]methanone
CID 95582872
[4-(aminomethyl)phenyl]-(3-ethoxypiperidin-1-yl)methanone
CID 54985369
4-(3-ethoxypiperidine-1-carbonyl)-1-methylpyridin-2-one
CID 47736704
(3-ethoxypiperidin-1-yl)-(9H-fluoren-2-yl)methanone
CID 47736856

Frequently Asked Questions

What is the IUPAC name of (3-ethoxypiperidin-1-yl)-quinoxalin-6-ylmethanone?
The IUPAC name of (3-ethoxypiperidin-1-yl)-quinoxalin-6-ylmethanone (CID 16734283) is (3-ethoxypiperidin-1-yl)-quinoxalin-6-ylmethanone.
What is the SMILES notation for (3-ethoxypiperidin-1-yl)-quinoxalin-6-ylmethanone?
The canonical SMILES for (3-ethoxypiperidin-1-yl)-quinoxalin-6-ylmethanone is CCOC1CCCN(C(=O)c2ccc3nccnc3c2)C1.
What is the InChIKey of (3-ethoxypiperidin-1-yl)-quinoxalin-6-ylmethanone?
The InChIKey is SHLDLIAQMUJRKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2/c1-2-21-13-4-3-9-19(11-13)16(20)12-5-6-14-15(10-12)18-8-7-17-14/h5-8,10,13H,2-4,9,11H2,1H3.
What are the key properties of (3-ethoxypiperidin-1-yl)-quinoxalin-6-ylmethanone?
(3-ethoxypiperidin-1-yl)-quinoxalin-6-ylmethanone has a molecular weight of 285.35 g/mol, XLogP of 2.27, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-ethoxypiperidin-1-yl)-quinoxalin-6-ylmethanone is sourced from PubChem (CID 16734283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).