(2-ethoxyphenyl)-[3-ethyl-4-(methylamino)piperidin-1-yl]methanone

C17H26N2O2 — CID 114506351

IUPAC(2-ethoxyphenyl)-[3-ethyl-4-(methylamino)piperidin-1-yl]methanone
SMILESCCOc1ccccc1C(=O)N1CCC(NC)C(CC)C1
InChIInChI=1S/C17H26N2O2/c1-4-13-12-19(11-10-15(13)18-3)17(20)14-8-6-7-9-16(14)21-5-2/h6-9,13,15,18H,4-5,10-12H2,1-3H3
InChIKeyREWYVKSLCRZHIH-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.55
Rot. Bonds5

About (2-ethoxyphenyl)-[3-ethyl-4-(methylamino)piperidin-1-yl]methanone

(2-ethoxyphenyl)-[3-ethyl-4-(methylamino)piperidin-1-yl]methanone (PubChem CID 114506351) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is (2-ethoxyphenyl)-[3-ethyl-4-(methylamino)piperidin-1-yl]methanone.

Molecular Properties

Compound Name(2-ethoxyphenyl)-[3-ethyl-4-(methylamino)piperidin-1-yl]methanone
PubChem CID114506351
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC Name(2-ethoxyphenyl)-[3-ethyl-4-(methylamino)piperidin-1-yl]methanone
SMILESCCOc1ccccc1C(=O)N1CCC(NC)C(CC)C1
InChIInChI=1S/C17H26N2O2/c1-4-13-12-19(11-10-15(13)18-3)17(20)14-8-6-7-9-16(14)21-5-2/h6-9,13,15,18H,4-5,10-12H2,1-3H3
InChIKeyREWYVKSLCRZHIH-UHFFFAOYSA-N
XLogP2.55
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (2-ethoxyphenyl)-[3-ethyl-4-(methylamino)piperidin-1-yl]methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

methyl 1-(2-ethoxybenzoyl)piperidine-3-carboxylate
CID 78919045
(2-ethoxyphenyl)-[4-(propylamino)piperidin-1-yl]methanone
CID 60817895
[3-(cyclopropylmethoxy)pyrrolidin-1-yl]-(2-ethoxyphenyl)methanone
CID 121022721
(3-amino-4-methylpyrrolidin-1-yl)-(2-ethoxyphenyl)methanone
CID 103576058
[2-(2-ethoxyphenoxy)phenyl]-[(3S)-3-(methylaminomethyl)pyrrolidin-1-yl]methanone
CID 124613165
[3-ethyl-4-(methylamino)piperidin-1-yl]-pyrazolo[1,5-a]pyridin-3-ylmethanone
CID 103115705
(4-bromo-2-hydroxyphenyl)-[3-ethyl-4-(methylamino)piperidin-1-yl]methanone
CID 114506286
1-[4-(2-ethoxybenzoyl)piperazin-1-yl]ethanone
CID 78795110
[2-[2-(dimethylamino)ethoxy]phenyl]-[3-(methylamino)piperidin-1-yl]methanone
CID 119489592
[3-ethyl-4-(methylamino)piperidin-1-yl]-(3-hydroxy-4-pyridinyl)methanone
CID 114506541
[(3S)-3-(aminomethyl)pyrrolidin-1-yl]-[2-(2-ethoxyphenoxy)phenyl]methanone
CID 124611885
[3-(2-chloroethyl)piperidin-1-yl]-(2-ethoxyphenyl)methanone
CID 63395748

Frequently Asked Questions

What is the IUPAC name of (2-ethoxyphenyl)-[3-ethyl-4-(methylamino)piperidin-1-yl]methanone?
The IUPAC name of (2-ethoxyphenyl)-[3-ethyl-4-(methylamino)piperidin-1-yl]methanone (CID 114506351) is (2-ethoxyphenyl)-[3-ethyl-4-(methylamino)piperidin-1-yl]methanone.
What is the SMILES notation for (2-ethoxyphenyl)-[3-ethyl-4-(methylamino)piperidin-1-yl]methanone?
The canonical SMILES for (2-ethoxyphenyl)-[3-ethyl-4-(methylamino)piperidin-1-yl]methanone is CCOc1ccccc1C(=O)N1CCC(NC)C(CC)C1.
What is the InChIKey of (2-ethoxyphenyl)-[3-ethyl-4-(methylamino)piperidin-1-yl]methanone?
The InChIKey is REWYVKSLCRZHIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-4-13-12-19(11-10-15(13)18-3)17(20)14-8-6-7-9-16(14)21-5-2/h6-9,13,15,18H,4-5,10-12H2,1-3H3.
What are the key properties of (2-ethoxyphenyl)-[3-ethyl-4-(methylamino)piperidin-1-yl]methanone?
(2-ethoxyphenyl)-[3-ethyl-4-(methylamino)piperidin-1-yl]methanone has a molecular weight of 290.41 g/mol, XLogP of 2.55, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethoxyphenyl)-[3-ethyl-4-(methylamino)piperidin-1-yl]methanone is sourced from PubChem (CID 114506351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).