2,6-dimethoxy-N-[2-(3-methoxyphenyl)-2-piperidin-1-ylethyl]benzamide

C23H30N2O4 — CID 112506691

IUPAC2,6-dimethoxy-N-[2-(3-methoxyphenyl)-2-piperidin-1-ylethyl]benzamide
SMILESCOc1cccc(C(CNC(=O)c2c(OC)cccc2OC)N2CCCCC2)c1
InChIInChI=1S/C23H30N2O4/c1-27-18-10-7-9-17(15-18)19(25-13-5-4-6-14-25)16-24-23(26)22-20(28-2)11-8-12-21(22)29-3/h7-12,15,19H,4-6,13-14,16H2,1-3H3,(H,24,26)
InChIKeyCAJKGAQDLUJWCO-UHFFFAOYSA-N
MW398.50 g/mol
LogP3.67
Rot. Bonds8

About 2,6-dimethoxy-N-[2-(3-methoxyphenyl)-2-piperidin-1-ylethyl]benzamide

2,6-dimethoxy-N-[2-(3-methoxyphenyl)-2-piperidin-1-ylethyl]benzamide (PubChem CID 112506691) has the molecular formula C23H30N2O4 and a molecular weight of 398.50 g/mol. Its IUPAC name is 2,6-dimethoxy-N-[2-(3-methoxyphenyl)-2-piperidin-1-ylethyl]benzamide.

Molecular Properties

Compound Name2,6-dimethoxy-N-[2-(3-methoxyphenyl)-2-piperidin-1-ylethyl]benzamide
PubChem CID112506691
Molecular FormulaC23H30N2O4
Molecular Weight398.50 g/mol
Exact Mass398.22
IUPAC Name2,6-dimethoxy-N-[2-(3-methoxyphenyl)-2-piperidin-1-ylethyl]benzamide
SMILESCOc1cccc(C(CNC(=O)c2c(OC)cccc2OC)N2CCCCC2)c1
InChIInChI=1S/C23H30N2O4/c1-27-18-10-7-9-17(15-18)19(25-13-5-4-6-14-25)16-24-23(26)22-20(28-2)11-8-12-21(22)29-3/h7-12,15,19H,4-6,13-14,16H2,1-3H3,(H,24,26)
InChIKeyCAJKGAQDLUJWCO-UHFFFAOYSA-N
XLogP3.67
TPSA60.03 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.50
LogP ≤ 53.67
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
N-[2-(3-chlorophenyl)-2-pyrrolidin-1-ylethyl]-2,6-dimethoxybenzamide
CID 112506810
1,3-bis[2-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]urea
CID 24658456
2-(2,5-dimethoxyphenyl)-N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]acetamide
CID 78822011
N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]azocane-1-carboxamide
CID 112806953
2,6-dimethoxy-N-(2-piperidin-1-yl-2-thiophen-3-ylethyl)benzamide
CID 16931257
3-iodo-N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]benzamide
CID 43005771
N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-2,2-dimethylpropanamide
CID 134026624
3-bromo-N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]benzamide
CID 43005762
N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-2,3-dimethylbenzamide
CID 43007764
4-(dimethylamino)-N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]benzamide
CID 43005778
4-(difluoromethoxy)-N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]benzamide
CID 43005704

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethoxy-N-[2-(3-methoxyphenyl)-2-piperidin-1-ylethyl]benzamide?
The IUPAC name of 2,6-dimethoxy-N-[2-(3-methoxyphenyl)-2-piperidin-1-ylethyl]benzamide (CID 112506691) is 2,6-dimethoxy-N-[2-(3-methoxyphenyl)-2-piperidin-1-ylethyl]benzamide.
What is the SMILES notation for 2,6-dimethoxy-N-[2-(3-methoxyphenyl)-2-piperidin-1-ylethyl]benzamide?
The canonical SMILES for 2,6-dimethoxy-N-[2-(3-methoxyphenyl)-2-piperidin-1-ylethyl]benzamide is COc1cccc(C(CNC(=O)c2c(OC)cccc2OC)N2CCCCC2)c1.
What is the InChIKey of 2,6-dimethoxy-N-[2-(3-methoxyphenyl)-2-piperidin-1-ylethyl]benzamide?
The InChIKey is CAJKGAQDLUJWCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30N2O4/c1-27-18-10-7-9-17(15-18)19(25-13-5-4-6-14-25)16-24-23(26)22-20(28-2)11-8-12-21(22)29-3/h7-12,15,19H,4-6,13-14,16H2,1-3H3,(H,24,26).
What are the key properties of 2,6-dimethoxy-N-[2-(3-methoxyphenyl)-2-piperidin-1-ylethyl]benzamide?
2,6-dimethoxy-N-[2-(3-methoxyphenyl)-2-piperidin-1-ylethyl]benzamide has a molecular weight of 398.50 g/mol, XLogP of 3.67, 8 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-(3-methoxyphenyl)-2-piperidin-1-ylethyl]benzamide is sourced from PubChem (CID 112506691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).