2-methoxy-N-[2-(2-methoxyphenyl)-2-piperidin-1-ylethyl]-5-methylbenzamide

C23H30N2O3 — CID 55887390

IUPAC2-methoxy-N-[2-(2-methoxyphenyl)-2-piperidin-1-ylethyl]-5-methylbenzamide
SMILESCOc1ccc(C)cc1C(=O)NCC(c1ccccc1OC)N1CCCCC1
InChIInChI=1S/C23H30N2O3/c1-17-11-12-22(28-3)19(15-17)23(26)24-16-20(25-13-7-4-8-14-25)18-9-5-6-10-21(18)27-2/h5-6,9-12,15,20H,4,7-8,13-14,16H2,1-3H3,(H,24,26)
InChIKeyFGJWNPNKBQFABK-UHFFFAOYSA-N
MW382.50 g/mol
LogP3.97
Rot. Bonds7

About 2-methoxy-N-[2-(2-methoxyphenyl)-2-piperidin-1-ylethyl]-5-methylbenzamide

2-methoxy-N-[2-(2-methoxyphenyl)-2-piperidin-1-ylethyl]-5-methylbenzamide (PubChem CID 55887390) has the molecular formula C23H30N2O3 and a molecular weight of 382.50 g/mol. Its IUPAC name is 2-methoxy-N-[2-(2-methoxyphenyl)-2-piperidin-1-ylethyl]-5-methylbenzamide.

Molecular Properties

Compound Name2-methoxy-N-[2-(2-methoxyphenyl)-2-piperidin-1-ylethyl]-5-methylbenzamide
PubChem CID55887390
Molecular FormulaC23H30N2O3
Molecular Weight382.50 g/mol
Exact Mass382.23
IUPAC Name2-methoxy-N-[2-(2-methoxyphenyl)-2-piperidin-1-ylethyl]-5-methylbenzamide
SMILESCOc1ccc(C)cc1C(=O)NCC(c1ccccc1OC)N1CCCCC1
InChIInChI=1S/C23H30N2O3/c1-17-11-12-22(28-3)19(15-17)23(26)24-16-20(25-13-7-4-8-14-25)18-9-5-6-10-21(18)27-2/h5-6,9-12,15,20H,4,7-8,13-14,16H2,1-3H3,(H,24,26)
InChIKeyFGJWNPNKBQFABK-UHFFFAOYSA-N
XLogP3.97
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.50
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-2,4,6-trimethylbenzamide
CID 112810457
2,4-dimethoxy-N-[2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]benzamide
CID 43006298
2-amino-N-[2-(2-methoxyphenyl)-2-piperidin-1-ylethyl]benzamide;dihydrochloride
CID 119946536
2-iodo-N-[(2S)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]benzamide
CID 31307195
3-methoxy-N-[2-(2-methoxyphenyl)-2-piperidin-1-ylethyl]-4-methylbenzamide
CID 60533969
methyl 4-[[2-(2-methoxyphenyl)-2-piperidin-1-ylethyl]carbamoyl]benzoate
CID 60533855
5-fluoro-2-hydroxy-N-[(2S)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]benzamide
CID 95787960
2-bromo-4-fluoro-N-[2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]benzamide
CID 24686009
3-fluoro-N-[2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]benzamide
CID 43006303
2-amino-N-[2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-2-(4-methylphenyl)acetamide
CID 120669331
N-[2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-1-(4-methylphenyl)-5-propan-2-ylpyrazole-4-carboxamide
CID 55628686
N-[2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-5-methylthiophene-2-carboxamide
CID 51164557

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[2-(2-methoxyphenyl)-2-piperidin-1-ylethyl]-5-methylbenzamide?
The IUPAC name of 2-methoxy-N-[2-(2-methoxyphenyl)-2-piperidin-1-ylethyl]-5-methylbenzamide (CID 55887390) is 2-methoxy-N-[2-(2-methoxyphenyl)-2-piperidin-1-ylethyl]-5-methylbenzamide.
What is the SMILES notation for 2-methoxy-N-[2-(2-methoxyphenyl)-2-piperidin-1-ylethyl]-5-methylbenzamide?
The canonical SMILES for 2-methoxy-N-[2-(2-methoxyphenyl)-2-piperidin-1-ylethyl]-5-methylbenzamide is COc1ccc(C)cc1C(=O)NCC(c1ccccc1OC)N1CCCCC1.
What is the InChIKey of 2-methoxy-N-[2-(2-methoxyphenyl)-2-piperidin-1-ylethyl]-5-methylbenzamide?
The InChIKey is FGJWNPNKBQFABK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30N2O3/c1-17-11-12-22(28-3)19(15-17)23(26)24-16-20(25-13-7-4-8-14-25)18-9-5-6-10-21(18)27-2/h5-6,9-12,15,20H,4,7-8,13-14,16H2,1-3H3,(H,24,26).
What are the key properties of 2-methoxy-N-[2-(2-methoxyphenyl)-2-piperidin-1-ylethyl]-5-methylbenzamide?
2-methoxy-N-[2-(2-methoxyphenyl)-2-piperidin-1-ylethyl]-5-methylbenzamide has a molecular weight of 382.50 g/mol, XLogP of 3.97, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[2-(2-methoxyphenyl)-2-piperidin-1-ylethyl]-5-methylbenzamide is sourced from PubChem (CID 55887390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).