N-(3-hydroxycyclobutyl)-3-(2-methoxyethoxy)benzamide

C14H19NO4 — CID 126818884

IUPACN-(3-hydroxycyclobutyl)-3-(2-methoxyethoxy)benzamide
SMILESCOCCOc1cccc(C(=O)NC2CC(O)C2)c1
InChIInChI=1S/C14H19NO4/c1-18-5-6-19-13-4-2-3-10(7-13)14(17)15-11-8-12(16)9-11/h2-4,7,11-12,16H,5-6,8-9H2,1H3,(H,15,17)
InChIKeyGDSDZLVTDBXCPC-UHFFFAOYSA-N
MW265.31 g/mol
LogP0.96
Rot. Bonds6

About N-(3-hydroxycyclobutyl)-3-(2-methoxyethoxy)benzamide

N-(3-hydroxycyclobutyl)-3-(2-methoxyethoxy)benzamide (PubChem CID 126818884) has the molecular formula C14H19NO4 and a molecular weight of 265.31 g/mol. Its IUPAC name is N-(3-hydroxycyclobutyl)-3-(2-methoxyethoxy)benzamide.

Molecular Properties

Compound NameN-(3-hydroxycyclobutyl)-3-(2-methoxyethoxy)benzamide
PubChem CID126818884
Molecular FormulaC14H19NO4
Molecular Weight265.31 g/mol
Exact Mass265.13
IUPAC NameN-(3-hydroxycyclobutyl)-3-(2-methoxyethoxy)benzamide
SMILESCOCCOc1cccc(C(=O)NC2CC(O)C2)c1
InChIInChI=1S/C14H19NO4/c1-18-5-6-19-13-4-2-3-10(7-13)14(17)15-11-8-12(16)9-11/h2-4,7,11-12,16H,5-6,8-9H2,1H3,(H,15,17)
InChIKeyGDSDZLVTDBXCPC-UHFFFAOYSA-N
XLogP0.96
TPSA67.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 50.96
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

3-(2-methoxyethoxy)-N-(3-morpholin-4-ylcyclobutyl)benzamide
CID 126822652
3-[2-[(3-hydroxycyclobutyl)amino]ethoxy]benzoic acid
CID 103255893
3-(3-methoxypropoxy)-N-piperidin-4-ylbenzamide
CID 119386846
4-[[3-(3-methoxypropoxy)benzoyl]amino]cyclohexane-1-carboxylic acid
CID 119229681
N-cyclohexyl-3-propoxybenzamide
CID 4960053
trans-(1S,2S)-2-[[3-(3-methoxypropoxy)benzoyl]amino]cyclohexane-1-carboxylic acid
CID 97324364
N-[2-(aminomethyl)cyclohexyl]-3-(2-methoxyethoxy)benzamide
CID 119609171
N-(4-hydroxycyclohexyl)-3-(3-methylbut-2-enoxy)benzamide
CID 111462854
1-[3-(4-methoxybutoxy)phenyl]ethanone
CID 57239152
N-(2-aminoethyl)-3-(2-methoxyethoxy)benzamide
CID 119381991
N-(4-bromocyclohexyl)-3-propoxybenzamide
CID 114308980
3-[[3-(2-methoxyethoxy)benzoyl]amino]propanoic acid
CID 119177030

Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxycyclobutyl)-3-(2-methoxyethoxy)benzamide?
The IUPAC name of N-(3-hydroxycyclobutyl)-3-(2-methoxyethoxy)benzamide (CID 126818884) is N-(3-hydroxycyclobutyl)-3-(2-methoxyethoxy)benzamide.
What is the SMILES notation for N-(3-hydroxycyclobutyl)-3-(2-methoxyethoxy)benzamide?
The canonical SMILES for N-(3-hydroxycyclobutyl)-3-(2-methoxyethoxy)benzamide is COCCOc1cccc(C(=O)NC2CC(O)C2)c1.
What is the InChIKey of N-(3-hydroxycyclobutyl)-3-(2-methoxyethoxy)benzamide?
The InChIKey is GDSDZLVTDBXCPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO4/c1-18-5-6-19-13-4-2-3-10(7-13)14(17)15-11-8-12(16)9-11/h2-4,7,11-12,16H,5-6,8-9H2,1H3,(H,15,17).
What are the key properties of N-(3-hydroxycyclobutyl)-3-(2-methoxyethoxy)benzamide?
N-(3-hydroxycyclobutyl)-3-(2-methoxyethoxy)benzamide has a molecular weight of 265.31 g/mol, XLogP of 0.96, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxycyclobutyl)-3-(2-methoxyethoxy)benzamide is sourced from PubChem (CID 126818884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).