N-(1-hydroxybutan-2-yl)-4-[(2-methylpropan-2-yl)oxy]benzamide

C15H23NO3 — CID 110466125

IUPACN-(1-hydroxybutan-2-yl)-4-[(2-methylpropan-2-yl)oxy]benzamide
SMILESCCC(CO)NC(=O)c1ccc(OC(C)(C)C)cc1
InChIInChI=1S/C15H23NO3/c1-5-12(10-17)16-14(18)11-6-8-13(9-7-11)19-15(2,3)4/h6-9,12,17H,5,10H2,1-4H3,(H,16,18)
InChIKeyRJGOXDUVKJMOER-UHFFFAOYSA-N
MW265.35 g/mol
LogP2.36
Rot. Bonds5

About N-(1-hydroxybutan-2-yl)-4-[(2-methylpropan-2-yl)oxy]benzamide

N-(1-hydroxybutan-2-yl)-4-[(2-methylpropan-2-yl)oxy]benzamide (PubChem CID 110466125) has the molecular formula C15H23NO3 and a molecular weight of 265.35 g/mol. Its IUPAC name is N-(1-hydroxybutan-2-yl)-4-[(2-methylpropan-2-yl)oxy]benzamide.

Molecular Properties

Compound NameN-(1-hydroxybutan-2-yl)-4-[(2-methylpropan-2-yl)oxy]benzamide
PubChem CID110466125
Molecular FormulaC15H23NO3
Molecular Weight265.35 g/mol
Exact Mass265.17
IUPAC NameN-(1-hydroxybutan-2-yl)-4-[(2-methylpropan-2-yl)oxy]benzamide
SMILESCCC(CO)NC(=O)c1ccc(OC(C)(C)C)cc1
InChIInChI=1S/C15H23NO3/c1-5-12(10-17)16-14(18)11-6-8-13(9-7-11)19-15(2,3)4/h6-9,12,17H,5,10H2,1-4H3,(H,16,18)
InChIKeyRJGOXDUVKJMOER-UHFFFAOYSA-N
XLogP2.36
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.35
LogP ≤ 52.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2R)-1-hydroxybutan-2-yl]-4-(trifluoromethoxy)benzamide
CID 103920258
4-[(4-tert-butylphenoxy)methyl]-N-(1-hydroxybutan-2-yl)benzamide
CID 112771460
4-(2-amino-2-oxoethoxy)-N-[(2S)-1-hydroxybutan-2-yl]benzamide
CID 104981373
N-[(2S)-1-hydroxybutan-2-yl]benzamide
CID 13129547
N-[(2S)-1-hydroxybutan-2-yl]-4-propan-2-ylbenzamide
CID 93032259
N-[(2R)-1-hydroxybutan-2-yl]-4-propan-2-ylbenzamide
CID 93032260
N-[(2R)-1-hydroxybutan-2-yl]-4-(propan-2-yloxymethyl)benzamide
CID 93041550
4-(2,3-dimethylpentanoylamino)-N-(1-hydroxybutan-2-yl)benzamide
CID 110026465
N-(1-hydroxybutan-2-yl)-1H-pyrrole-3-carboxamide
CID 141279449
N-(1-hydroxy-3-methoxypropan-2-yl)-4-methoxybenzamide
CID 114078956
3,4-difluoro-N-[(2R)-1-hydroxybutan-2-yl]benzamide
CID 103920331
N-(1-chlorobutan-2-yl)-4-methoxybenzamide
CID 114294761

Frequently Asked Questions

What is the IUPAC name of N-(1-hydroxybutan-2-yl)-4-[(2-methylpropan-2-yl)oxy]benzamide?
The IUPAC name of N-(1-hydroxybutan-2-yl)-4-[(2-methylpropan-2-yl)oxy]benzamide (CID 110466125) is N-(1-hydroxybutan-2-yl)-4-[(2-methylpropan-2-yl)oxy]benzamide.
What is the SMILES notation for N-(1-hydroxybutan-2-yl)-4-[(2-methylpropan-2-yl)oxy]benzamide?
The canonical SMILES for N-(1-hydroxybutan-2-yl)-4-[(2-methylpropan-2-yl)oxy]benzamide is CCC(CO)NC(=O)c1ccc(OC(C)(C)C)cc1.
What is the InChIKey of N-(1-hydroxybutan-2-yl)-4-[(2-methylpropan-2-yl)oxy]benzamide?
The InChIKey is RJGOXDUVKJMOER-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO3/c1-5-12(10-17)16-14(18)11-6-8-13(9-7-11)19-15(2,3)4/h6-9,12,17H,5,10H2,1-4H3,(H,16,18).
What are the key properties of N-(1-hydroxybutan-2-yl)-4-[(2-methylpropan-2-yl)oxy]benzamide?
N-(1-hydroxybutan-2-yl)-4-[(2-methylpropan-2-yl)oxy]benzamide has a molecular weight of 265.35 g/mol, XLogP of 2.36, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxybutan-2-yl)-4-[(2-methylpropan-2-yl)oxy]benzamide is sourced from PubChem (CID 110466125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).