2,6-dimethoxy-N-(2-piperidin-1-yl-2-thiophen-3-ylethyl)benzamide

C20H26N2O3S — CID 16931257

IUPAC2,6-dimethoxy-N-(2-piperidin-1-yl-2-thiophen-3-ylethyl)benzamide
SMILESCOc1cccc(OC)c1C(=O)NCC(c1ccsc1)N1CCCCC1
InChIInChI=1S/C20H26N2O3S/c1-24-17-7-6-8-18(25-2)19(17)20(23)21-13-16(15-9-12-26-14-15)22-10-4-3-5-11-22/h6-9,12,14,16H,3-5,10-11,13H2,1-2H3,(H,21,23)
InChIKeyNZKLQYXWDFCIRC-UHFFFAOYSA-N
MW374.51 g/mol
LogP3.72
Rot. Bonds7

About 2,6-dimethoxy-N-(2-piperidin-1-yl-2-thiophen-3-ylethyl)benzamide

2,6-dimethoxy-N-(2-piperidin-1-yl-2-thiophen-3-ylethyl)benzamide (PubChem CID 16931257) has the molecular formula C20H26N2O3S and a molecular weight of 374.51 g/mol. Its IUPAC name is 2,6-dimethoxy-N-(2-piperidin-1-yl-2-thiophen-3-ylethyl)benzamide.

Molecular Properties

Compound Name2,6-dimethoxy-N-(2-piperidin-1-yl-2-thiophen-3-ylethyl)benzamide
PubChem CID16931257
Molecular FormulaC20H26N2O3S
Molecular Weight374.51 g/mol
Exact Mass374.17
IUPAC Name2,6-dimethoxy-N-(2-piperidin-1-yl-2-thiophen-3-ylethyl)benzamide
SMILESCOc1cccc(OC)c1C(=O)NCC(c1ccsc1)N1CCCCC1
InChIInChI=1S/C20H26N2O3S/c1-24-17-7-6-8-18(25-2)19(17)20(23)21-13-16(15-9-12-26-14-15)22-10-4-3-5-11-22/h6-9,12,14,16H,3-5,10-11,13H2,1-2H3,(H,21,23)
InChIKeyNZKLQYXWDFCIRC-UHFFFAOYSA-N
XLogP3.72
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.51
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2,6-dimethoxy-N-(2-phenyl-2-pyrrolidin-1-ylethyl)benzamide
CID 112503241
2,3,4-trimethoxy-N-(2-pyrrolidin-1-yl-2-thiophen-3-ylethyl)benzamide
CID 16931575
N-[2-(azepan-1-yl)-2-thiophen-3-ylethyl]-2,4-dimethoxybenzamide
CID 16931874
2,6-dimethoxy-N-[2-(3-methoxyphenyl)-2-piperidin-1-ylethyl]benzamide
CID 112506691
N-[2-(azetidin-1-yl)-2-thiophen-3-ylethyl]-7-methoxy-1-benzofuran-2-carboxamide
CID 91813433
3,5-dimethoxy-N-(2-piperidin-1-yl-2-thiophen-3-ylethyl)benzamide
CID 16931236
N'-(2-methoxyphenyl)-N-[(2R)-2-pyrrolidin-1-yl-2-thiophen-3-ylethyl]oxamide
CID 40848858
[2-[[2-(azepan-1-yl)-2-thiophen-3-ylethyl]carbamoyl]phenyl] acetate
CID 16931836
N-[2-(azepan-1-yl)-2-thiophen-3-ylethyl]benzamide
CID 16931885
N-[2-(3-chlorophenyl)-2-pyrrolidin-1-ylethyl]-2,6-dimethoxybenzamide
CID 112506810
N-[2-(azepan-1-yl)-2-thiophen-3-ylethyl]-2-(4-methoxyphenyl)acetamide
CID 16931779
N'-(3-methoxyphenyl)-N-(2-piperidin-1-yl-2-thiophen-3-ylethyl)oxamide
CID 16932195

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethoxy-N-(2-piperidin-1-yl-2-thiophen-3-ylethyl)benzamide?
The IUPAC name of 2,6-dimethoxy-N-(2-piperidin-1-yl-2-thiophen-3-ylethyl)benzamide (CID 16931257) is 2,6-dimethoxy-N-(2-piperidin-1-yl-2-thiophen-3-ylethyl)benzamide.
What is the SMILES notation for 2,6-dimethoxy-N-(2-piperidin-1-yl-2-thiophen-3-ylethyl)benzamide?
The canonical SMILES for 2,6-dimethoxy-N-(2-piperidin-1-yl-2-thiophen-3-ylethyl)benzamide is COc1cccc(OC)c1C(=O)NCC(c1ccsc1)N1CCCCC1.
What is the InChIKey of 2,6-dimethoxy-N-(2-piperidin-1-yl-2-thiophen-3-ylethyl)benzamide?
The InChIKey is NZKLQYXWDFCIRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O3S/c1-24-17-7-6-8-18(25-2)19(17)20(23)21-13-16(15-9-12-26-14-15)22-10-4-3-5-11-22/h6-9,12,14,16H,3-5,10-11,13H2,1-2H3,(H,21,23).
What are the key properties of 2,6-dimethoxy-N-(2-piperidin-1-yl-2-thiophen-3-ylethyl)benzamide?
2,6-dimethoxy-N-(2-piperidin-1-yl-2-thiophen-3-ylethyl)benzamide has a molecular weight of 374.51 g/mol, XLogP of 3.72, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethoxy-N-(2-piperidin-1-yl-2-thiophen-3-ylethyl)benzamide is sourced from PubChem (CID 16931257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).