2-[2,6-dimethoxy-4-(3-methylpiperidine-1-carbonyl)phenoxy]acetamide

C17H24N2O5 — CID 51265105

IUPAC2-[2,6-dimethoxy-4-(3-methylpiperidine-1-carbonyl)phenoxy]acetamide
SMILESCOc1cc(C(=O)N2CCCC(C)C2)cc(OC)c1OCC(N)=O
InChIInChI=1S/C17H24N2O5/c1-11-5-4-6-19(9-11)17(21)12-7-13(22-2)16(14(8-12)23-3)24-10-15(18)20/h7-8,11H,4-6,9-10H2,1-3H3,(H2,18,20)
InChIKeyMZVVZDZCWBPIRF-UHFFFAOYSA-N
MW336.39 g/mol
LogP1.44
Rot. Bonds6

About 2-[2,6-dimethoxy-4-(3-methylpiperidine-1-carbonyl)phenoxy]acetamide

2-[2,6-dimethoxy-4-(3-methylpiperidine-1-carbonyl)phenoxy]acetamide (PubChem CID 51265105) has the molecular formula C17H24N2O5 and a molecular weight of 336.39 g/mol. Its IUPAC name is 2-[2,6-dimethoxy-4-(3-methylpiperidine-1-carbonyl)phenoxy]acetamide.

Molecular Properties

Compound Name2-[2,6-dimethoxy-4-(3-methylpiperidine-1-carbonyl)phenoxy]acetamide
PubChem CID51265105
Molecular FormulaC17H24N2O5
Molecular Weight336.39 g/mol
Exact Mass336.17
IUPAC Name2-[2,6-dimethoxy-4-(3-methylpiperidine-1-carbonyl)phenoxy]acetamide
SMILESCOc1cc(C(=O)N2CCCC(C)C2)cc(OC)c1OCC(N)=O
InChIInChI=1S/C17H24N2O5/c1-11-5-4-6-19(9-11)17(21)12-7-13(22-2)16(14(8-12)23-3)24-10-15(18)20/h7-8,11H,4-6,9-10H2,1-3H3,(H2,18,20)
InChIKeyMZVVZDZCWBPIRF-UHFFFAOYSA-N
XLogP1.44
TPSA91.09 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.39
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[4-[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline-2-carbonyl]-2,6-dimethoxyphenoxy]acetamide
CID 9490021
2-[4-[(4aS,8aS)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline-2-carbonyl]-2,6-dimethoxyphenoxy]acetamide
CID 9490022
1-[4-(2-amino-2-oxoethoxy)-3-chloro-5-methoxybenzoyl]-N-methylpiperidine-3-carboxamide
CID 119128285
1-[4-(2-amino-2-oxoethoxy)-3-chloro-5-methoxybenzoyl]-N-phenylpiperidine-3-carboxamide
CID 24637988
2-[2-chloro-4-(4,4-dimethylazepane-1-carbonyl)-6-methoxyphenoxy]acetamide
CID 119138060
2-[2-chloro-6-methoxy-4-(4-propoxyazepane-1-carbonyl)phenoxy]acetamide
CID 119125753
(4-methoxy-3-methylphenyl)-[(3S)-3-methylpiperidin-1-yl]methanone
CID 95970544
2-[4-[4-(2-amino-2-oxoethoxy)-3-chloro-5-methoxybenzoyl]morpholin-2-yl]acetic acid
CID 119247780
(3,4-dimethoxyphenyl)-(3-methylpyrrolidin-1-yl)methanone
CID 110749717
(3R,4R)-1-[4-(2-amino-2-oxoethoxy)-3-chloro-5-methoxybenzoyl]-4-cyclopropylpyrrolidine-3-carboxylic acid
CID 120980126
2-[2-chloro-6-methoxy-4-[2-(methylaminomethyl)pyrrolidine-1-carbonyl]phenoxy]acetamide;hydrochloride
CID 119651087
2-[4-[4-(4-cyanophenyl)-1,4-diazepane-1-carbonyl]-2,6-dimethoxyphenoxy]acetamide
CID 55715861

Frequently Asked Questions

What is the IUPAC name of 2-[2,6-dimethoxy-4-(3-methylpiperidine-1-carbonyl)phenoxy]acetamide?
The IUPAC name of 2-[2,6-dimethoxy-4-(3-methylpiperidine-1-carbonyl)phenoxy]acetamide (CID 51265105) is 2-[2,6-dimethoxy-4-(3-methylpiperidine-1-carbonyl)phenoxy]acetamide.
What is the SMILES notation for 2-[2,6-dimethoxy-4-(3-methylpiperidine-1-carbonyl)phenoxy]acetamide?
The canonical SMILES for 2-[2,6-dimethoxy-4-(3-methylpiperidine-1-carbonyl)phenoxy]acetamide is COc1cc(C(=O)N2CCCC(C)C2)cc(OC)c1OCC(N)=O.
What is the InChIKey of 2-[2,6-dimethoxy-4-(3-methylpiperidine-1-carbonyl)phenoxy]acetamide?
The InChIKey is MZVVZDZCWBPIRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O5/c1-11-5-4-6-19(9-11)17(21)12-7-13(22-2)16(14(8-12)23-3)24-10-15(18)20/h7-8,11H,4-6,9-10H2,1-3H3,(H2,18,20).
What are the key properties of 2-[2,6-dimethoxy-4-(3-methylpiperidine-1-carbonyl)phenoxy]acetamide?
2-[2,6-dimethoxy-4-(3-methylpiperidine-1-carbonyl)phenoxy]acetamide has a molecular weight of 336.39 g/mol, XLogP of 1.44, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2,6-dimethoxy-4-(3-methylpiperidine-1-carbonyl)phenoxy]acetamide is sourced from PubChem (CID 51265105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).