[2-[(2R)-2-methylpiperidin-1-yl]-2-oxoethyl] 2-[(3,5-dimethoxybenzoyl)amino]acetate

C19H26N2O6 — CID 7884221

IUPAC[2-[(2R)-2-methylpiperidin-1-yl]-2-oxoethyl] 2-[(3,5-dimethoxybenzoyl)amino]acetate
SMILESCOc1cc(OC)cc(C(=O)NCC(=O)OCC(=O)N2CCCC[C@H]2C)c1
InChIInChI=1S/C19H26N2O6/c1-13-6-4-5-7-21(13)17(22)12-27-18(23)11-20-19(24)14-8-15(25-2)10-16(9-14)26-3/h8-10,13H,4-7,11-12H2,1-3H3,(H,20,24)/t13-/m1/s1
InChIKeyIDZCERUJQHWLKY-CYBMUJFWSA-N
MW378.43 g/mol
LogP1.38
Rot. Bonds7

About [2-[(2R)-2-methylpiperidin-1-yl]-2-oxoethyl] 2-[(3,5-dimethoxybenzoyl)amino]acetate

[2-[(2R)-2-methylpiperidin-1-yl]-2-oxoethyl] 2-[(3,5-dimethoxybenzoyl)amino]acetate (PubChem CID 7884221) has the molecular formula C19H26N2O6 and a molecular weight of 378.43 g/mol. Its IUPAC name is [2-[(2R)-2-methylpiperidin-1-yl]-2-oxoethyl] 2-[(3,5-dimethoxybenzoyl)amino]acetate.

Molecular Properties

Compound Name[2-[(2R)-2-methylpiperidin-1-yl]-2-oxoethyl] 2-[(3,5-dimethoxybenzoyl)amino]acetate
PubChem CID7884221
Molecular FormulaC19H26N2O6
Molecular Weight378.43 g/mol
Exact Mass378.18
IUPAC Name[2-[(2R)-2-methylpiperidin-1-yl]-2-oxoethyl] 2-[(3,5-dimethoxybenzoyl)amino]acetate
SMILESCOc1cc(OC)cc(C(=O)NCC(=O)OCC(=O)N2CCCC[C@H]2C)c1
InChIInChI=1S/C19H26N2O6/c1-13-6-4-5-7-21(13)17(22)12-27-18(23)11-20-19(24)14-8-15(25-2)10-16(9-14)26-3/h8-10,13H,4-7,11-12H2,1-3H3,(H,20,24)/t13-/m1/s1
InChIKeyIDZCERUJQHWLKY-CYBMUJFWSA-N
XLogP1.38
TPSA94.17 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.43
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze [2-[(2R)-2-methylpiperidin-1-yl]-2-oxoethyl] 2-[(3,5-dimethoxybenzoyl)amino]acetate with MolForge

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Related Compounds

[2-[(2R)-2-methylpiperidin-1-yl]-2-oxoethyl] 2-[(4-phenoxybenzoyl)amino]acetate
CID 8790284
[2-(2-methylpiperidin-1-yl)-2-oxoethyl] 2-[(3-bromobenzoyl)amino]acetate
CID 55320566
[2-[(2R)-2-methylpiperidin-1-yl]-2-oxoethyl] 2-[(3-nitrobenzoyl)amino]acetate
CID 9269520
[2-[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-2-oxoethyl] 2-[(4-methoxybenzoyl)amino]acetate
CID 9345629
N-[2-(azepan-1-yl)-2-oxoethyl]-3,5-dimethoxybenzamide
CID 26500774
2-(4-methoxyphenoxy)-1-(2-methylpiperidin-1-yl)ethanone
CID 4541588
[2-[[(1R)-1-cyclopropylethyl]amino]-2-oxoethyl] 2-[(3,5-dimethoxybenzoyl)amino]acetate
CID 8574391
[2-[(3S)-3-methylpiperidin-1-yl]-2-oxoethyl] 2-[(4-methoxybenzoyl)amino]acetate
CID 8788846
[2-[(2S)-2-ethylpiperidin-1-yl]-2-oxoethyl] 2-[(4-ethoxybenzoyl)amino]acetate
CID 7884861
[2-[(2R)-2-methylpiperidin-1-yl]-2-oxoethyl] 3,5-dimethoxy-4-methylbenzoate
CID 2505986
[2-[(2R)-2-methylpiperidin-1-yl]-2-oxoethyl] 2-hydroxy-5-methoxybenzoate
CID 41105144
[2-(2-methylpiperidin-1-yl)-2-oxoethyl] 4-bromo-3,5-dimethoxybenzoate
CID 46627369

Frequently Asked Questions

What is the IUPAC name of [2-[(2R)-2-methylpiperidin-1-yl]-2-oxoethyl] 2-[(3,5-dimethoxybenzoyl)amino]acetate?
The IUPAC name of [2-[(2R)-2-methylpiperidin-1-yl]-2-oxoethyl] 2-[(3,5-dimethoxybenzoyl)amino]acetate (CID 7884221) is [2-[(2R)-2-methylpiperidin-1-yl]-2-oxoethyl] 2-[(3,5-dimethoxybenzoyl)amino]acetate.
What is the SMILES notation for [2-[(2R)-2-methylpiperidin-1-yl]-2-oxoethyl] 2-[(3,5-dimethoxybenzoyl)amino]acetate?
The canonical SMILES for [2-[(2R)-2-methylpiperidin-1-yl]-2-oxoethyl] 2-[(3,5-dimethoxybenzoyl)amino]acetate is COc1cc(OC)cc(C(=O)NCC(=O)OCC(=O)N2CCCC[C@H]2C)c1.
What is the InChIKey of [2-[(2R)-2-methylpiperidin-1-yl]-2-oxoethyl] 2-[(3,5-dimethoxybenzoyl)amino]acetate?
The InChIKey is IDZCERUJQHWLKY-CYBMUJFWSA-N. The full InChI is InChI=1S/C19H26N2O6/c1-13-6-4-5-7-21(13)17(22)12-27-18(23)11-20-19(24)14-8-15(25-2)10-16(9-14)26-3/h8-10,13H,4-7,11-12H2,1-3H3,(H,20,24)/t13-/m1/s1.
What are the key properties of [2-[(2R)-2-methylpiperidin-1-yl]-2-oxoethyl] 2-[(3,5-dimethoxybenzoyl)amino]acetate?
[2-[(2R)-2-methylpiperidin-1-yl]-2-oxoethyl] 2-[(3,5-dimethoxybenzoyl)amino]acetate has a molecular weight of 378.43 g/mol, XLogP of 1.38, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(2R)-2-methylpiperidin-1-yl]-2-oxoethyl] 2-[(3,5-dimethoxybenzoyl)amino]acetate is sourced from PubChem (CID 7884221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).