2,3,4-trimethoxy-N-(2-methyl-3-piperidin-1-ylpropyl)benzamide

C19H30N2O4 — CID 55980283

IUPAC2,3,4-trimethoxy-N-(2-methyl-3-piperidin-1-ylpropyl)benzamide
SMILESCOc1ccc(C(=O)NCC(C)CN2CCCCC2)c(OC)c1OC
InChIInChI=1S/C19H30N2O4/c1-14(13-21-10-6-5-7-11-21)12-20-19(22)15-8-9-16(23-2)18(25-4)17(15)24-3/h8-9,14H,5-7,10-13H2,1-4H3,(H,20,22)
InChIKeySDHFRUBNZVUSQF-UHFFFAOYSA-N
MW350.46 g/mol
LogP2.56
Rot. Bonds8

About 2,3,4-trimethoxy-N-(2-methyl-3-piperidin-1-ylpropyl)benzamide

2,3,4-trimethoxy-N-(2-methyl-3-piperidin-1-ylpropyl)benzamide (PubChem CID 55980283) has the molecular formula C19H30N2O4 and a molecular weight of 350.46 g/mol. Its IUPAC name is 2,3,4-trimethoxy-N-(2-methyl-3-piperidin-1-ylpropyl)benzamide.

Molecular Properties

Compound Name2,3,4-trimethoxy-N-(2-methyl-3-piperidin-1-ylpropyl)benzamide
PubChem CID55980283
Molecular FormulaC19H30N2O4
Molecular Weight350.46 g/mol
Exact Mass350.22
IUPAC Name2,3,4-trimethoxy-N-(2-methyl-3-piperidin-1-ylpropyl)benzamide
SMILESCOc1ccc(C(=O)NCC(C)CN2CCCCC2)c(OC)c1OC
InChIInChI=1S/C19H30N2O4/c1-14(13-21-10-6-5-7-11-21)12-20-19(22)15-8-9-16(23-2)18(25-4)17(15)24-3/h8-9,14H,5-7,10-13H2,1-4H3,(H,20,22)
InChIKeySDHFRUBNZVUSQF-UHFFFAOYSA-N
XLogP2.56
TPSA60.03 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.46
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3-chloro-2-methylpropyl)-2,3,4-trimethoxybenzamide
CID 114302515
3-fluoro-4-methoxy-N-(2-methyl-3-piperidin-1-ylpropyl)benzamide
CID 86824610
N-[(2S)-2-hydroxypropyl]-2,3,4-trimethoxybenzamide
CID 83030336
2-bromo-5-methoxy-N-(2-methyl-3-piperidin-1-ylpropyl)benzamide
CID 55885642
2,3,4-trimethoxy-N-[1-(3-methylpiperidin-1-yl)propan-2-yl]benzamide
CID 60572108
2,3,4-trimethoxy-N-[(1-piperidin-1-ylcyclohexyl)methyl]benzamide
CID 2449625
2,3,4-trimethoxy-N-(2-pyrrolidin-1-yl-2-thiophen-3-ylethyl)benzamide
CID 16931575
2,3,4-trimethoxy-N-[(2S)-2-(1-methylpyrrol-2-yl)-2-pyrrolidin-1-ylethyl]benzamide
CID 42217682
2-bromo-N-(2-methyl-3-piperidin-1-ylpropyl)furan-3-carboxamide
CID 106853640
(E)-3-[2-(difluoromethoxy)-3-methoxyphenyl]-N-(2-methyl-3-piperidin-1-ylpropyl)prop-2-enamide
CID 55980532
2-chloro-N-(2-methyl-3-pyrrolidin-1-ylpropyl)furan-3-carboxamide
CID 106686782
2-methoxy-N-[1-[(2-methyl-3-piperidin-1-ylpropyl)amino]-4-methylsulfanyl-1-oxobutan-2-yl]benzamide
CID 55979629

Frequently Asked Questions

What is the IUPAC name of 2,3,4-trimethoxy-N-(2-methyl-3-piperidin-1-ylpropyl)benzamide?
The IUPAC name of 2,3,4-trimethoxy-N-(2-methyl-3-piperidin-1-ylpropyl)benzamide (CID 55980283) is 2,3,4-trimethoxy-N-(2-methyl-3-piperidin-1-ylpropyl)benzamide.
What is the SMILES notation for 2,3,4-trimethoxy-N-(2-methyl-3-piperidin-1-ylpropyl)benzamide?
The canonical SMILES for 2,3,4-trimethoxy-N-(2-methyl-3-piperidin-1-ylpropyl)benzamide is COc1ccc(C(=O)NCC(C)CN2CCCCC2)c(OC)c1OC.
What is the InChIKey of 2,3,4-trimethoxy-N-(2-methyl-3-piperidin-1-ylpropyl)benzamide?
The InChIKey is SDHFRUBNZVUSQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N2O4/c1-14(13-21-10-6-5-7-11-21)12-20-19(22)15-8-9-16(23-2)18(25-4)17(15)24-3/h8-9,14H,5-7,10-13H2,1-4H3,(H,20,22).
What are the key properties of 2,3,4-trimethoxy-N-(2-methyl-3-piperidin-1-ylpropyl)benzamide?
2,3,4-trimethoxy-N-(2-methyl-3-piperidin-1-ylpropyl)benzamide has a molecular weight of 350.46 g/mol, XLogP of 2.56, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,4-trimethoxy-N-(2-methyl-3-piperidin-1-ylpropyl)benzamide is sourced from PubChem (CID 55980283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).