N-(2-ethoxyphenyl)-4-thiophen-2-ylpiperidine-1-carboxamide

C18H22N2O2S — CID 90522272

IUPACN-(2-ethoxyphenyl)-4-thiophen-2-ylpiperidine-1-carboxamide
SMILESCCOc1ccccc1NC(=O)N1CCC(c2cccs2)CC1
InChIInChI=1S/C18H22N2O2S/c1-2-22-16-7-4-3-6-15(16)19-18(21)20-11-9-14(10-12-20)17-8-5-13-23-17/h3-8,13-14H,2,9-12H2,1H3,(H,19,21)
InChIKeyROAHJNFBQJDXQG-UHFFFAOYSA-N
MW330.45 g/mol
LogP4.56
Rot. Bonds4

About N-(2-ethoxyphenyl)-4-thiophen-2-ylpiperidine-1-carboxamide

N-(2-ethoxyphenyl)-4-thiophen-2-ylpiperidine-1-carboxamide (PubChem CID 90522272) has the molecular formula C18H22N2O2S and a molecular weight of 330.45 g/mol. Its IUPAC name is N-(2-ethoxyphenyl)-4-thiophen-2-ylpiperidine-1-carboxamide.

Molecular Properties

Compound NameN-(2-ethoxyphenyl)-4-thiophen-2-ylpiperidine-1-carboxamide
PubChem CID90522272
Molecular FormulaC18H22N2O2S
Molecular Weight330.45 g/mol
Exact Mass330.14
IUPAC NameN-(2-ethoxyphenyl)-4-thiophen-2-ylpiperidine-1-carboxamide
SMILESCCOc1ccccc1NC(=O)N1CCC(c2cccs2)CC1
InChIInChI=1S/C18H22N2O2S/c1-2-22-16-7-4-3-6-15(16)19-18(21)20-11-9-14(10-12-20)17-8-5-13-23-17/h3-8,13-14H,2,9-12H2,1H3,(H,19,21)
InChIKeyROAHJNFBQJDXQG-UHFFFAOYSA-N
XLogP4.56
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.45
LogP ≤ 54.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(2-ethoxyphenyl)-4-thiophen-2-ylpiperidine-1-carboxamide 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

N-(2-ethoxyphenyl)-7-thiophen-2-yl-1,4-thiazepane-4-carboxamide
CID 90632987
(2R)-N-(2-ethoxyphenyl)-2-thiophen-2-ylazepane-1-carboxamide
CID 92503136
4-cyclopropylidene-N-(2-ethoxyphenyl)piperidine-1-carboxamide
CID 121187160
(4aS,8aS)-N-(2-ethoxyphenyl)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline-2-carboxamide
CID 51944761
N-(2-ethoxyphenyl)-3-methylsulfonylpyrrolidine-1-carboxamide
CID 90584758
N-(2-ethoxyphenyl)-4-formylpiperazine-1-carboxamide
CID 108988617
N-(2-ethoxyphenyl)-4-(1-methylsulfonylpiperidin-4-yl)oxypiperidine-1-carboxamide
CID 91916489
N-(2-ethoxyphenyl)-4-phenylpiperazine-1-carboxamide
CID 108989544
N-(2-ethoxyphenyl)-4-(triazol-1-yl)piperidine-1-carboxamide
CID 121151383
N-(2-ethoxyphenyl)-3,4-dihydro-1H-isoquinoline-2-carboxamide
CID 6469538
N-(2-ethoxyphenyl)-4-[(4-thiophen-2-yl-1,3-thiazol-2-yl)methyl]piperazine-1-carboxamide
CID 30464389
4-benzyl-N-(2-ethoxyphenyl)piperazine-1-carboxamide
CID 6468674

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyphenyl)-4-thiophen-2-ylpiperidine-1-carboxamide?
The IUPAC name of N-(2-ethoxyphenyl)-4-thiophen-2-ylpiperidine-1-carboxamide (CID 90522272) is N-(2-ethoxyphenyl)-4-thiophen-2-ylpiperidine-1-carboxamide.
What is the SMILES notation for N-(2-ethoxyphenyl)-4-thiophen-2-ylpiperidine-1-carboxamide?
The canonical SMILES for N-(2-ethoxyphenyl)-4-thiophen-2-ylpiperidine-1-carboxamide is CCOc1ccccc1NC(=O)N1CCC(c2cccs2)CC1.
What is the InChIKey of N-(2-ethoxyphenyl)-4-thiophen-2-ylpiperidine-1-carboxamide?
The InChIKey is ROAHJNFBQJDXQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O2S/c1-2-22-16-7-4-3-6-15(16)19-18(21)20-11-9-14(10-12-20)17-8-5-13-23-17/h3-8,13-14H,2,9-12H2,1H3,(H,19,21).
What are the key properties of N-(2-ethoxyphenyl)-4-thiophen-2-ylpiperidine-1-carboxamide?
N-(2-ethoxyphenyl)-4-thiophen-2-ylpiperidine-1-carboxamide has a molecular weight of 330.45 g/mol, XLogP of 4.56, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyphenyl)-4-thiophen-2-ylpiperidine-1-carboxamide is sourced from PubChem (CID 90522272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).