N-(2-methoxyethyl)-2-[3-(4-methylpiperidine-1-carbonyl)anilino]acetamide

C18H27N3O3 — CID 54842818

IUPACN-(2-methoxyethyl)-2-[3-(4-methylpiperidine-1-carbonyl)anilino]acetamide
SMILESCOCCNC(=O)CNc1cccc(C(=O)N2CCC(C)CC2)c1
InChIInChI=1S/C18H27N3O3/c1-14-6-9-21(10-7-14)18(23)15-4-3-5-16(12-15)20-13-17(22)19-8-11-24-2/h3-5,12,14,20H,6-11,13H2,1-2H3,(H,19,22)
InChIKeyGYEYCPLKKQUEAG-UHFFFAOYSA-N
MW333.43 g/mol
LogP1.73
Rot. Bonds7

About N-(2-methoxyethyl)-2-[3-(4-methylpiperidine-1-carbonyl)anilino]acetamide

N-(2-methoxyethyl)-2-[3-(4-methylpiperidine-1-carbonyl)anilino]acetamide (PubChem CID 54842818) has the molecular formula C18H27N3O3 and a molecular weight of 333.43 g/mol. Its IUPAC name is N-(2-methoxyethyl)-2-[3-(4-methylpiperidine-1-carbonyl)anilino]acetamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-2-[3-(4-methylpiperidine-1-carbonyl)anilino]acetamide
PubChem CID54842818
Molecular FormulaC18H27N3O3
Molecular Weight333.43 g/mol
Exact Mass333.21
IUPAC NameN-(2-methoxyethyl)-2-[3-(4-methylpiperidine-1-carbonyl)anilino]acetamide
SMILESCOCCNC(=O)CNc1cccc(C(=O)N2CCC(C)CC2)c1
InChIInChI=1S/C18H27N3O3/c1-14-6-9-21(10-7-14)18(23)15-4-3-5-16(12-15)20-13-17(22)19-8-11-24-2/h3-5,12,14,20H,6-11,13H2,1-2H3,(H,19,22)
InChIKeyGYEYCPLKKQUEAG-UHFFFAOYSA-N
XLogP1.73
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.43
LogP ≤ 51.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(3-methoxypropyl)-3-[[2-[3-(4-methylpiperidine-1-carbonyl)anilino]acetyl]amino]benzamide
CID 54843162
2-[3-(4-methylpiperidine-1-carbonyl)anilino]-N-(2-phenylethyl)acetamide
CID 54843363
N-[3-(2-methoxyethoxy)phenyl]-2-[3-(4-methylpiperidine-1-carbonyl)anilino]acetamide
CID 54843222
N-(2-methoxyethyl)-3-[[2-[3-(pyrrolidine-1-carbonyl)anilino]acetyl]amino]benzamide
CID 54841294
2-[4-(2-methoxyethoxy)anilino]-N-[3-(4-methylpiperidine-1-carbonyl)phenyl]acetamide
CID 54822272
N-(4-methoxyphenyl)-2-[3-(4-methylpiperidine-1-carbonyl)anilino]acetamide
CID 54843609
N-(2-methoxyethylcarbamoyl)-2-[3-(morpholine-4-carbonyl)anilino]acetamide
CID 55896994
N-(4-acetamidophenyl)-2-[3-(4-methylpiperidine-1-carbonyl)anilino]acetamide
CID 54843300
2-anilino-N-[3-(4-methylpiperidine-1-carbonyl)phenyl]acetamide
CID 54810526
N-ethyl-4-[[2-[3-(4-methylpiperidine-1-carbonyl)anilino]acetyl]amino]benzamide
CID 54843069
N-(2-methoxyethyl)-4-[[2-[4-(4-methylpiperidine-1-carbonyl)anilino]-2-oxoethyl]amino]benzamide
CID 54836112
N-[4-(4-methylpiperidine-1-carbonyl)phenyl]-2-[3-(pyrrolidine-1-carbonyl)anilino]acetamide
CID 54841292

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-2-[3-(4-methylpiperidine-1-carbonyl)anilino]acetamide?
The IUPAC name of N-(2-methoxyethyl)-2-[3-(4-methylpiperidine-1-carbonyl)anilino]acetamide (CID 54842818) is N-(2-methoxyethyl)-2-[3-(4-methylpiperidine-1-carbonyl)anilino]acetamide.
What is the SMILES notation for N-(2-methoxyethyl)-2-[3-(4-methylpiperidine-1-carbonyl)anilino]acetamide?
The canonical SMILES for N-(2-methoxyethyl)-2-[3-(4-methylpiperidine-1-carbonyl)anilino]acetamide is COCCNC(=O)CNc1cccc(C(=O)N2CCC(C)CC2)c1.
What is the InChIKey of N-(2-methoxyethyl)-2-[3-(4-methylpiperidine-1-carbonyl)anilino]acetamide?
The InChIKey is GYEYCPLKKQUEAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27N3O3/c1-14-6-9-21(10-7-14)18(23)15-4-3-5-16(12-15)20-13-17(22)19-8-11-24-2/h3-5,12,14,20H,6-11,13H2,1-2H3,(H,19,22).
What are the key properties of N-(2-methoxyethyl)-2-[3-(4-methylpiperidine-1-carbonyl)anilino]acetamide?
N-(2-methoxyethyl)-2-[3-(4-methylpiperidine-1-carbonyl)anilino]acetamide has a molecular weight of 333.43 g/mol, XLogP of 1.73, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-2-[3-(4-methylpiperidine-1-carbonyl)anilino]acetamide is sourced from PubChem (CID 54842818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).