3-(2-methoxyethoxy)-N-methyl-N-piperidin-4-ylbenzamide

C16H24N2O3 — CID 119441131

IUPAC3-(2-methoxyethoxy)-N-methyl-N-piperidin-4-ylbenzamide
SMILESCOCCOc1cccc(C(=O)N(C)C2CCNCC2)c1
InChIInChI=1S/C16H24N2O3/c1-18(14-6-8-17-9-7-14)16(19)13-4-3-5-15(12-13)21-11-10-20-2/h3-5,12,14,17H,6-11H2,1-2H3
InChIKeyBVJIDNVEHRYVFR-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.54
Rot. Bonds6

About 3-(2-methoxyethoxy)-N-methyl-N-piperidin-4-ylbenzamide

3-(2-methoxyethoxy)-N-methyl-N-piperidin-4-ylbenzamide (PubChem CID 119441131) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is 3-(2-methoxyethoxy)-N-methyl-N-piperidin-4-ylbenzamide.

Molecular Properties

Compound Name3-(2-methoxyethoxy)-N-methyl-N-piperidin-4-ylbenzamide
PubChem CID119441131
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC Name3-(2-methoxyethoxy)-N-methyl-N-piperidin-4-ylbenzamide
SMILESCOCCOc1cccc(C(=O)N(C)C2CCNCC2)c1
InChIInChI=1S/C16H24N2O3/c1-18(14-6-8-17-9-7-14)16(19)13-4-3-5-15(12-13)21-11-10-20-2/h3-5,12,14,17H,6-11H2,1-2H3
InChIKeyBVJIDNVEHRYVFR-UHFFFAOYSA-N
XLogP1.54
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-(3-methoxypropoxy)-N-methyl-N-piperidin-4-ylbenzamide;hydrochloride
CID 119441938
3-ethoxy-N-methyl-N-piperidin-4-ylbenzamide
CID 119443526
3-(2-methoxyethoxy)-N-piperidin-4-yl-N-propylbenzamide
CID 119822999
3-methoxy-N-methyl-N-pyrrolidin-3-ylbenzamide
CID 60806673
4-(3-acetylphenoxy)-N-methyl-N-piperidin-4-ylbutanamide;hydrochloride
CID 119443722
3-(3-methoxypropoxy)-N-propyl-N-pyrrolidin-3-ylbenzamide;hydrochloride
CID 119530577
N-methyl-N-piperidin-4-yl-3-pyrazin-2-yloxybenzamide;dihydrochloride
CID 119442827
4-(3-methoxypropoxy)-N-methyl-N-pyrrolidin-3-ylbenzamide
CID 119552321
3-(3-methoxypropoxy)-N-piperidin-4-ylbenzamide
CID 119386846
N-methyl-N-piperidin-4-yl-3,4-dipropoxybenzamide
CID 119443973
N-methyl-4-(3-methylphenoxy)-N-piperidin-4-ylbutanamide
CID 119442665
4-(3-acetylphenoxy)-N-methyl-N-pyrrolidin-3-ylbutanamide
CID 119553580

Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxyethoxy)-N-methyl-N-piperidin-4-ylbenzamide?
The IUPAC name of 3-(2-methoxyethoxy)-N-methyl-N-piperidin-4-ylbenzamide (CID 119441131) is 3-(2-methoxyethoxy)-N-methyl-N-piperidin-4-ylbenzamide.
What is the SMILES notation for 3-(2-methoxyethoxy)-N-methyl-N-piperidin-4-ylbenzamide?
The canonical SMILES for 3-(2-methoxyethoxy)-N-methyl-N-piperidin-4-ylbenzamide is COCCOc1cccc(C(=O)N(C)C2CCNCC2)c1.
What is the InChIKey of 3-(2-methoxyethoxy)-N-methyl-N-piperidin-4-ylbenzamide?
The InChIKey is BVJIDNVEHRYVFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3/c1-18(14-6-8-17-9-7-14)16(19)13-4-3-5-15(12-13)21-11-10-20-2/h3-5,12,14,17H,6-11H2,1-2H3.
What are the key properties of 3-(2-methoxyethoxy)-N-methyl-N-piperidin-4-ylbenzamide?
3-(2-methoxyethoxy)-N-methyl-N-piperidin-4-ylbenzamide has a molecular weight of 292.38 g/mol, XLogP of 1.54, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxyethoxy)-N-methyl-N-piperidin-4-ylbenzamide is sourced from PubChem (CID 119441131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).