N-(2-hydroxyethyl)-3,5-bis(phenylmethoxy)benzamide

C23H23NO4 — CID 171338561

IUPACN-(2-hydroxyethyl)-3,5-bis(phenylmethoxy)benzamide
SMILESO=C(NCCO)c1cc(OCc2ccccc2)cc(OCc2ccccc2)c1
InChIInChI=1S/C23H23NO4/c25-12-11-24-23(26)20-13-21(27-16-18-7-3-1-4-8-18)15-22(14-20)28-17-19-9-5-2-6-10-19/h1-10,13-15,25H,11-12,16-17H2,(H,24,26)
InChIKeyAKRSXWMQRUUIRM-UHFFFAOYSA-N
MW377.44 g/mol
LogP3.57
Rot. Bonds9

About N-(2-hydroxyethyl)-3,5-bis(phenylmethoxy)benzamide

N-(2-hydroxyethyl)-3,5-bis(phenylmethoxy)benzamide (PubChem CID 171338561) has the molecular formula C23H23NO4 and a molecular weight of 377.44 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-3,5-bis(phenylmethoxy)benzamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-3,5-bis(phenylmethoxy)benzamide
PubChem CID171338561
Molecular FormulaC23H23NO4
Molecular Weight377.44 g/mol
Exact Mass377.16
IUPAC NameN-(2-hydroxyethyl)-3,5-bis(phenylmethoxy)benzamide
SMILESO=C(NCCO)c1cc(OCc2ccccc2)cc(OCc2ccccc2)c1
InChIInChI=1S/C23H23NO4/c25-12-11-24-23(26)20-13-21(27-16-18-7-3-1-4-8-18)15-22(14-20)28-17-19-9-5-2-6-10-19/h1-10,13-15,25H,11-12,16-17H2,(H,24,26)
InChIKeyAKRSXWMQRUUIRM-UHFFFAOYSA-N
XLogP3.57
TPSA67.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.44
LogP ≤ 53.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-hydroxyethyl)-4-phenylmethoxybenzamide
CID 10825986
3,5-bis(phenylmethoxy)benzoate
CID 6986896
N-(2-aminoethyl)-4-phenylmethoxybenzamide
CID 13064036
4-phenylmethoxy-N-propylbenzamide
CID 4958389
N-pentyl-3-phenylmethoxybenzamide
CID 112759707
N-(3-hydroxybutyl)-3-phenylmethoxybenzamide
CID 111433563
dimethyl 5-phenylmethoxybenzene-1,3-dicarboxylate
CID 7643390
3-(2-methoxyethoxy)-5-phenylmethoxybenzoic acid
CID 21250893
3-ethoxy-5-hydroxy-N-(2-hydroxyethyl)benzamide
CID 153269388
N-(3-aminobutyl)-3-phenylmethoxybenzamide;hydrochloride
CID 119497996
N-[3-(dimethylamino)propyl]-3,4,5-tris(phenylmethoxy)benzamide
CID 3289624
N-(2-hydroxyethyl)-4-[(2-phenylmethoxyphenyl)methylsulfanyl]benzamide
CID 18789573

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-3,5-bis(phenylmethoxy)benzamide?
The IUPAC name of N-(2-hydroxyethyl)-3,5-bis(phenylmethoxy)benzamide (CID 171338561) is N-(2-hydroxyethyl)-3,5-bis(phenylmethoxy)benzamide.
What is the SMILES notation for N-(2-hydroxyethyl)-3,5-bis(phenylmethoxy)benzamide?
The canonical SMILES for N-(2-hydroxyethyl)-3,5-bis(phenylmethoxy)benzamide is O=C(NCCO)c1cc(OCc2ccccc2)cc(OCc2ccccc2)c1.
What is the InChIKey of N-(2-hydroxyethyl)-3,5-bis(phenylmethoxy)benzamide?
The InChIKey is AKRSXWMQRUUIRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23NO4/c25-12-11-24-23(26)20-13-21(27-16-18-7-3-1-4-8-18)15-22(14-20)28-17-19-9-5-2-6-10-19/h1-10,13-15,25H,11-12,16-17H2,(H,24,26).
What are the key properties of N-(2-hydroxyethyl)-3,5-bis(phenylmethoxy)benzamide?
N-(2-hydroxyethyl)-3,5-bis(phenylmethoxy)benzamide has a molecular weight of 377.44 g/mol, XLogP of 3.57, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-3,5-bis(phenylmethoxy)benzamide is sourced from PubChem (CID 171338561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).