4-tert-butyl-N-[4-(2-hydroxyethoxy)phenyl]benzamide

C19H23NO3 — CID 14698589

IUPAC4-tert-butyl-N-[4-(2-hydroxyethoxy)phenyl]benzamide
SMILESCC(C)(C)c1ccc(C(=O)Nc2ccc(OCCO)cc2)cc1
InChIInChI=1S/C19H23NO3/c1-19(2,3)15-6-4-14(5-7-15)18(22)20-16-8-10-17(11-9-16)23-13-12-21/h4-11,21H,12-13H2,1-3H3,(H,20,22)
InChIKeyGMCJAONQCOGFIY-UHFFFAOYSA-N
MW313.40 g/mol
LogP3.61
Rot. Bonds5

About 4-tert-butyl-N-[4-(2-hydroxyethoxy)phenyl]benzamide

4-tert-butyl-N-[4-(2-hydroxyethoxy)phenyl]benzamide (PubChem CID 14698589) has the molecular formula C19H23NO3 and a molecular weight of 313.40 g/mol. Its IUPAC name is 4-tert-butyl-N-[4-(2-hydroxyethoxy)phenyl]benzamide.

Molecular Properties

Compound Name4-tert-butyl-N-[4-(2-hydroxyethoxy)phenyl]benzamide
PubChem CID14698589
Molecular FormulaC19H23NO3
Molecular Weight313.40 g/mol
Exact Mass313.17
IUPAC Name4-tert-butyl-N-[4-(2-hydroxyethoxy)phenyl]benzamide
SMILESCC(C)(C)c1ccc(C(=O)Nc2ccc(OCCO)cc2)cc1
InChIInChI=1S/C19H23NO3/c1-19(2,3)15-6-4-14(5-7-15)18(22)20-16-8-10-17(11-9-16)23-13-12-21/h4-11,21H,12-13H2,1-3H3,(H,20,22)
InChIKeyGMCJAONQCOGFIY-UHFFFAOYSA-N
XLogP3.61
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.40
LogP ≤ 53.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[4-[(4-tert-butylbenzoyl)amino]phenoxy]acetate
CID 6952976
4-(2-methoxyethoxy)-N-[4-(2-methoxyethoxy)phenyl]benzamide
CID 15943272
N-[4-(2-hydroxyethoxy)phenyl]-6-methylpyridine-3-carboxamide
CID 111113144
4-[(4-butoxybenzoyl)amino]-N-methylbenzamide
CID 9164625
N-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]-4-(3-hydroxypropoxy)benzamide
CID 134941315
3-chloro-N-[4-(2-hydroxyethoxy)phenyl]-4-methylbenzamide
CID 111116205
4-tert-butyl-N-[4-[2-oxo-2-(propan-2-ylamino)ethoxy]phenyl]benzamide
CID 9252674
4-(4-oxopentoxy)-N-[4-[[4-(4-oxopentoxy)benzoyl]amino]phenyl]benzamide
CID 23520545
4-tert-butyl-N-(4-phenoxyphenyl)benzamide
CID 675709
4-(2-ethoxyethoxy)-N-[4-[[4-(2-ethoxyethoxy)benzoyl]amino]phenyl]benzamide
CID 17113406
methyl 4-[[4-(2-methoxyethoxy)phenyl]carbamoyl]benzoate
CID 17178280
4-tert-butyl-N-[4-[[[2-(4-phenylphenoxy)acetyl]amino]carbamoyl]phenyl]benzamide
CID 4513398

Frequently Asked Questions

What is the IUPAC name of 4-tert-butyl-N-[4-(2-hydroxyethoxy)phenyl]benzamide?
The IUPAC name of 4-tert-butyl-N-[4-(2-hydroxyethoxy)phenyl]benzamide (CID 14698589) is 4-tert-butyl-N-[4-(2-hydroxyethoxy)phenyl]benzamide.
What is the SMILES notation for 4-tert-butyl-N-[4-(2-hydroxyethoxy)phenyl]benzamide?
The canonical SMILES for 4-tert-butyl-N-[4-(2-hydroxyethoxy)phenyl]benzamide is CC(C)(C)c1ccc(C(=O)Nc2ccc(OCCO)cc2)cc1.
What is the InChIKey of 4-tert-butyl-N-[4-(2-hydroxyethoxy)phenyl]benzamide?
The InChIKey is GMCJAONQCOGFIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO3/c1-19(2,3)15-6-4-14(5-7-15)18(22)20-16-8-10-17(11-9-16)23-13-12-21/h4-11,21H,12-13H2,1-3H3,(H,20,22).
What are the key properties of 4-tert-butyl-N-[4-(2-hydroxyethoxy)phenyl]benzamide?
4-tert-butyl-N-[4-(2-hydroxyethoxy)phenyl]benzamide has a molecular weight of 313.40 g/mol, XLogP of 3.61, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tert-butyl-N-[4-(2-hydroxyethoxy)phenyl]benzamide is sourced from PubChem (CID 14698589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).