(2-ethoxyphenyl)-(2-methylpiperidin-1-yl)methanone

C15H21NO2 — CID 2932679

IUPAC(2-ethoxyphenyl)-(2-methylpiperidin-1-yl)methanone
SMILESCCOc1ccccc1C(=O)N1CCCCC1C
InChIInChI=1S/C15H21NO2/c1-3-18-14-10-5-4-9-13(14)15(17)16-11-7-6-8-12(16)2/h4-5,9-10,12H,3,6-8,11H2,1-2H3
InChIKeyFCAHFHIFBQQYTP-UHFFFAOYSA-N
MW247.34 g/mol
LogP3.10
Rot. Bonds3

About (2-ethoxyphenyl)-(2-methylpiperidin-1-yl)methanone

(2-ethoxyphenyl)-(2-methylpiperidin-1-yl)methanone (PubChem CID 2932679) has the molecular formula C15H21NO2 and a molecular weight of 247.34 g/mol. Its IUPAC name is (2-ethoxyphenyl)-(2-methylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name(2-ethoxyphenyl)-(2-methylpiperidin-1-yl)methanone
PubChem CID2932679
Molecular FormulaC15H21NO2
Molecular Weight247.34 g/mol
Exact Mass247.16
IUPAC Name(2-ethoxyphenyl)-(2-methylpiperidin-1-yl)methanone
SMILESCCOc1ccccc1C(=O)N1CCCCC1C
InChIInChI=1S/C15H21NO2/c1-3-18-14-10-5-4-9-13(14)15(17)16-11-7-6-8-12(16)2/h4-5,9-10,12H,3,6-8,11H2,1-2H3
InChIKeyFCAHFHIFBQQYTP-UHFFFAOYSA-N
XLogP3.10
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 53.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2-ethoxyphenyl)-(2-methylpiperidin-1-yl)methanone?
The IUPAC name of (2-ethoxyphenyl)-(2-methylpiperidin-1-yl)methanone (CID 2932679) is (2-ethoxyphenyl)-(2-methylpiperidin-1-yl)methanone.
What is the SMILES notation for (2-ethoxyphenyl)-(2-methylpiperidin-1-yl)methanone?
The canonical SMILES for (2-ethoxyphenyl)-(2-methylpiperidin-1-yl)methanone is CCOc1ccccc1C(=O)N1CCCCC1C.
What is the InChIKey of (2-ethoxyphenyl)-(2-methylpiperidin-1-yl)methanone?
The InChIKey is FCAHFHIFBQQYTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO2/c1-3-18-14-10-5-4-9-13(14)15(17)16-11-7-6-8-12(16)2/h4-5,9-10,12H,3,6-8,11H2,1-2H3.
What are the key properties of (2-ethoxyphenyl)-(2-methylpiperidin-1-yl)methanone?
(2-ethoxyphenyl)-(2-methylpiperidin-1-yl)methanone has a molecular weight of 247.34 g/mol, XLogP of 3.10, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethoxyphenyl)-(2-methylpiperidin-1-yl)methanone is sourced from PubChem (CID 2932679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).