3-hydroxy-N-(2-methoxyethyl)-N-(3-methoxypropyl)benzamide

C14H21NO4 — CID 54989912

IUPAC3-hydroxy-N-(2-methoxyethyl)-N-(3-methoxypropyl)benzamide
SMILESCOCCCN(CCOC)C(=O)c1cccc(O)c1
InChIInChI=1S/C14H21NO4/c1-18-9-4-7-15(8-10-19-2)14(17)12-5-3-6-13(16)11-12/h3,5-6,11,16H,4,7-10H2,1-2H3
InChIKeyRIHQAHWVFOIOHP-UHFFFAOYSA-N
MW267.32 g/mol
LogP1.52
Rot. Bonds8

About 3-hydroxy-N-(2-methoxyethyl)-N-(3-methoxypropyl)benzamide

3-hydroxy-N-(2-methoxyethyl)-N-(3-methoxypropyl)benzamide (PubChem CID 54989912) has the molecular formula C14H21NO4 and a molecular weight of 267.32 g/mol. Its IUPAC name is 3-hydroxy-N-(2-methoxyethyl)-N-(3-methoxypropyl)benzamide.

Molecular Properties

Compound Name3-hydroxy-N-(2-methoxyethyl)-N-(3-methoxypropyl)benzamide
PubChem CID54989912
Molecular FormulaC14H21NO4
Molecular Weight267.32 g/mol
Exact Mass267.15
IUPAC Name3-hydroxy-N-(2-methoxyethyl)-N-(3-methoxypropyl)benzamide
SMILESCOCCCN(CCOC)C(=O)c1cccc(O)c1
InChIInChI=1S/C14H21NO4/c1-18-9-4-7-15(8-10-19-2)14(17)12-5-3-6-13(16)11-12/h3,5-6,11,16H,4,7-10H2,1-2H3
InChIKeyRIHQAHWVFOIOHP-UHFFFAOYSA-N
XLogP1.52
TPSA59.00 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.32
LogP ≤ 51.52
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

N-(3-amino-3-sulfanylidenepropyl)-3-hydroxy-N-(2-methoxyethyl)benzamide
CID 55172473
3-(chloromethyl)-N-(2-methoxyethyl)-N-(3-methoxypropyl)benzamide
CID 60981417
3-[butyl(2-methoxyethyl)carbamoyl]benzoic acid
CID 120691896
3-hydroxy-4-methoxy-N-(2-methoxyethyl)-N-(3-methoxypropyl)benzamide
CID 79672066
2,5-dihydroxy-N-(2-methoxyethyl)-N-(3-methoxypropyl)benzamide
CID 103892150
N-(2-methoxyethyl)-N-(3-methoxypropyl)-4-methylbenzamide
CID 70804384
N-(2-methoxyethyl)-N-(3-methoxypropyl)-4-sulfanylbenzamide
CID 107026123
3-bromo-4-methoxy-N-(2-methoxyethyl)-N-(3-methoxypropyl)benzamide
CID 61025267
2-fluoro-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridine-4-carboxamide
CID 61293810
3,4,5-trifluoro-N-(2-methoxyethyl)-N-(3-methoxypropyl)benzamide
CID 63188742
3-[benzoyl(3-methoxypropyl)amino]propanoic acid
CID 82324502
N-(2-methoxyethyl)-N-(3-methoxypropyl)-2,3-dihydro-1H-isoindole-5-carboxamide
CID 103998591

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-N-(2-methoxyethyl)-N-(3-methoxypropyl)benzamide?
The IUPAC name of 3-hydroxy-N-(2-methoxyethyl)-N-(3-methoxypropyl)benzamide (CID 54989912) is 3-hydroxy-N-(2-methoxyethyl)-N-(3-methoxypropyl)benzamide.
What is the SMILES notation for 3-hydroxy-N-(2-methoxyethyl)-N-(3-methoxypropyl)benzamide?
The canonical SMILES for 3-hydroxy-N-(2-methoxyethyl)-N-(3-methoxypropyl)benzamide is COCCCN(CCOC)C(=O)c1cccc(O)c1.
What is the InChIKey of 3-hydroxy-N-(2-methoxyethyl)-N-(3-methoxypropyl)benzamide?
The InChIKey is RIHQAHWVFOIOHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO4/c1-18-9-4-7-15(8-10-19-2)14(17)12-5-3-6-13(16)11-12/h3,5-6,11,16H,4,7-10H2,1-2H3.
What are the key properties of 3-hydroxy-N-(2-methoxyethyl)-N-(3-methoxypropyl)benzamide?
3-hydroxy-N-(2-methoxyethyl)-N-(3-methoxypropyl)benzamide has a molecular weight of 267.32 g/mol, XLogP of 1.52, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-N-(2-methoxyethyl)-N-(3-methoxypropyl)benzamide is sourced from PubChem (CID 54989912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).