N-(2-hydroxyethyl)-3-methoxy-4-methyl-N-(2-phenylethyl)benzamide

C19H23NO3 — CID 111122063

IUPACN-(2-hydroxyethyl)-3-methoxy-4-methyl-N-(2-phenylethyl)benzamide
SMILESCOc1cc(C(=O)N(CCO)CCc2ccccc2)ccc1C
InChIInChI=1S/C19H23NO3/c1-15-8-9-17(14-18(15)23-2)19(22)20(12-13-21)11-10-16-6-4-3-5-7-16/h3-9,14,21H,10-13H2,1-2H3
InChIKeyRQBWEWXSBZBURJ-UHFFFAOYSA-N
MW313.40 g/mol
LogP2.68
Rot. Bonds7

About N-(2-hydroxyethyl)-3-methoxy-4-methyl-N-(2-phenylethyl)benzamide

N-(2-hydroxyethyl)-3-methoxy-4-methyl-N-(2-phenylethyl)benzamide (PubChem CID 111122063) has the molecular formula C19H23NO3 and a molecular weight of 313.40 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-3-methoxy-4-methyl-N-(2-phenylethyl)benzamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-3-methoxy-4-methyl-N-(2-phenylethyl)benzamide
PubChem CID111122063
Molecular FormulaC19H23NO3
Molecular Weight313.40 g/mol
Exact Mass313.17
IUPAC NameN-(2-hydroxyethyl)-3-methoxy-4-methyl-N-(2-phenylethyl)benzamide
SMILESCOc1cc(C(=O)N(CCO)CCc2ccccc2)ccc1C
InChIInChI=1S/C19H23NO3/c1-15-8-9-17(14-18(15)23-2)19(22)20(12-13-21)11-10-16-6-4-3-5-7-16/h3-9,14,21H,10-13H2,1-2H3
InChIKeyRQBWEWXSBZBURJ-UHFFFAOYSA-N
XLogP2.68
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.40
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-hydroxyethyl)-3-methoxy-N-(2-methoxyethyl)-4-methylbenzamide
CID 115772556
N-(2-aminoethyl)-3,5-dimethoxy-4-methyl-N-(2-phenylethyl)benzamide
CID 120884398
2-[2-phenylethyl-(3,4,5-trimethoxybenzoyl)amino]acetic acid
CID 100592353
N-(2-hydroxyethyl)-2-methyl-N-(2-phenylethyl)benzamide
CID 111122128
N-(2-hydroxyethyl)-2,4-dimethyl-N-(2-phenylethyl)benzamide
CID 111122151
N-(2-aminoethyl)-3-methoxy-4-[2-(methylamino)-2-oxoethoxy]-N-(2-phenylethyl)benzamide
CID 120886264
2-[ethyl-(3-methoxy-4-methylbenzoyl)amino]acetic acid
CID 54900774
N-(2-aminoethyl)-4-(difluoromethoxy)-3-methoxy-N-(2-phenylethyl)benzamide;hydrochloride
CID 120886341
3-[ethyl-(3-methoxy-4-methylbenzoyl)amino]propanoic acid
CID 54898498
N-(2-hydroxyethyl)-1-methyl-2-oxo-N-(2-phenylethyl)-3H-benzimidazole-5-carboxamide
CID 111122028
3,4-dimethoxy-N-(3-oxo-3-piperazin-1-ylpropyl)-N-(2-phenylethyl)benzamide
CID 50779264
5-[(4-fluoro-3-methoxybenzoyl)-(3-phenylpropyl)amino]pentanoic acid
CID 131988227

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-3-methoxy-4-methyl-N-(2-phenylethyl)benzamide?
The IUPAC name of N-(2-hydroxyethyl)-3-methoxy-4-methyl-N-(2-phenylethyl)benzamide (CID 111122063) is N-(2-hydroxyethyl)-3-methoxy-4-methyl-N-(2-phenylethyl)benzamide.
What is the SMILES notation for N-(2-hydroxyethyl)-3-methoxy-4-methyl-N-(2-phenylethyl)benzamide?
The canonical SMILES for N-(2-hydroxyethyl)-3-methoxy-4-methyl-N-(2-phenylethyl)benzamide is COc1cc(C(=O)N(CCO)CCc2ccccc2)ccc1C.
What is the InChIKey of N-(2-hydroxyethyl)-3-methoxy-4-methyl-N-(2-phenylethyl)benzamide?
The InChIKey is RQBWEWXSBZBURJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO3/c1-15-8-9-17(14-18(15)23-2)19(22)20(12-13-21)11-10-16-6-4-3-5-7-16/h3-9,14,21H,10-13H2,1-2H3.
What are the key properties of N-(2-hydroxyethyl)-3-methoxy-4-methyl-N-(2-phenylethyl)benzamide?
N-(2-hydroxyethyl)-3-methoxy-4-methyl-N-(2-phenylethyl)benzamide has a molecular weight of 313.40 g/mol, XLogP of 2.68, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-3-methoxy-4-methyl-N-(2-phenylethyl)benzamide is sourced from PubChem (CID 111122063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).