(2-ethoxypiperidin-1-yl)-phenylmethanone

C14H19NO2 — CID 134988342

IUPAC(2-ethoxypiperidin-1-yl)-phenylmethanone
SMILESCCOC1CCCCN1C(=O)c1ccccc1
InChIInChI=1S/C14H19NO2/c1-2-17-13-10-6-7-11-15(13)14(16)12-8-4-3-5-9-12/h3-5,8-9,13H,2,6-7,10-11H2,1H3
InChIKeyDFNIYLMNERSWGG-UHFFFAOYSA-N
MW233.31 g/mol
LogP2.68
Rot. Bonds3

About (2-ethoxypiperidin-1-yl)-phenylmethanone

(2-ethoxypiperidin-1-yl)-phenylmethanone (PubChem CID 134988342) has the molecular formula C14H19NO2 and a molecular weight of 233.31 g/mol. Its IUPAC name is (2-ethoxypiperidin-1-yl)-phenylmethanone.

Molecular Properties

Compound Name(2-ethoxypiperidin-1-yl)-phenylmethanone
PubChem CID134988342
Molecular FormulaC14H19NO2
Molecular Weight233.31 g/mol
Exact Mass233.14
IUPAC Name(2-ethoxypiperidin-1-yl)-phenylmethanone
SMILESCCOC1CCCCN1C(=O)c1ccccc1
InChIInChI=1S/C14H19NO2/c1-2-17-13-10-6-7-11-15(13)14(16)12-8-4-3-5-9-12/h3-5,8-9,13H,2,6-7,10-11H2,1H3
InChIKeyDFNIYLMNERSWGG-UHFFFAOYSA-N
XLogP2.68
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 52.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

phenyl-(2-propylpiperidin-1-yl)methanone
CID 16637839
(2-hydroxypiperidin-1-yl)-phenylmethanone
CID 14920288
ethyl (2S)-2-ethoxypiperidine-1-carboxylate
CID 92983244
ethyl 2-phenylmethoxyazepane-1-carboxylate
CID 141418493
(2-ethylpyrrolidin-1-yl)-phenylmethanone
CID 20577009
2-methylpropyl 1-benzoylpiperidine-2-carboxylate
CID 100995685
[(2S)-2-(dimethoxymethyl)piperidin-1-yl]-phenylmethanone
CID 44540070
[4-[(2S)-2-methylpiperidine-1-carbonyl]phenyl]-phenylmethanone
CID 2532732
[(2S)-2-benzylpiperidin-1-yl]-phenylmethanone
CID 155929798
[2-(1-phenoxyethyl)piperidin-1-yl]-phenylmethanone
CID 90696413
[4-[(2S)-2-ethylpiperidine-1-carbonyl]phenyl]-[(2R)-2-ethylpiperidin-1-yl]methanone
CID 1087323
phenyl-[(2S)-2-(2-pyrrolidin-1-ylethyl)piperidin-1-yl]methanone
CID 29348343

Frequently Asked Questions

What is the IUPAC name of (2-ethoxypiperidin-1-yl)-phenylmethanone?
The IUPAC name of (2-ethoxypiperidin-1-yl)-phenylmethanone (CID 134988342) is (2-ethoxypiperidin-1-yl)-phenylmethanone.
What is the SMILES notation for (2-ethoxypiperidin-1-yl)-phenylmethanone?
The canonical SMILES for (2-ethoxypiperidin-1-yl)-phenylmethanone is CCOC1CCCCN1C(=O)c1ccccc1.
What is the InChIKey of (2-ethoxypiperidin-1-yl)-phenylmethanone?
The InChIKey is DFNIYLMNERSWGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO2/c1-2-17-13-10-6-7-11-15(13)14(16)12-8-4-3-5-9-12/h3-5,8-9,13H,2,6-7,10-11H2,1H3.
What are the key properties of (2-ethoxypiperidin-1-yl)-phenylmethanone?
(2-ethoxypiperidin-1-yl)-phenylmethanone has a molecular weight of 233.31 g/mol, XLogP of 2.68, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethoxypiperidin-1-yl)-phenylmethanone is sourced from PubChem (CID 134988342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).