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

C17H19NO2 — CID 765444

IUPACN-[1-(4-hydroxyphenyl)-2-methylpropan-2-yl]benzamide
SMILESCC(C)(Cc1ccc(O)cc1)NC(=O)c1ccccc1
InChIInChI=1S/C17H19NO2/c1-17(2,12-13-8-10-15(19)11-9-13)18-16(20)14-6-4-3-5-7-14/h3-11,19H,12H2,1-2H3,(H,18,20)
InChIKeyYLAMOOVOHCNTLN-UHFFFAOYSA-N
MW269.34 g/mol
LogP3.14
Rot. Bonds4

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

N-[1-(4-hydroxyphenyl)-2-methylpropan-2-yl]benzamide (PubChem CID 765444) has the molecular formula C17H19NO2 and a molecular weight of 269.34 g/mol. Its IUPAC name is N-[1-(4-hydroxyphenyl)-2-methylpropan-2-yl]benzamide.

Molecular Properties

Compound NameN-[1-(4-hydroxyphenyl)-2-methylpropan-2-yl]benzamide
PubChem CID765444
Molecular FormulaC17H19NO2
Molecular Weight269.34 g/mol
Exact Mass269.14
IUPAC NameN-[1-(4-hydroxyphenyl)-2-methylpropan-2-yl]benzamide
SMILESCC(C)(Cc1ccc(O)cc1)NC(=O)c1ccccc1
InChIInChI=1S/C17H19NO2/c1-17(2,12-13-8-10-15(19)11-9-13)18-16(20)14-6-4-3-5-7-14/h3-11,19H,12H2,1-2H3,(H,18,20)
InChIKeyYLAMOOVOHCNTLN-UHFFFAOYSA-N
XLogP3.14
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.34
LogP ≤ 53.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[1-(4-hydroxyphenyl)-2-methylpropan-2-yl]benzamide?
The IUPAC name of N-[1-(4-hydroxyphenyl)-2-methylpropan-2-yl]benzamide (CID 765444) is N-[1-(4-hydroxyphenyl)-2-methylpropan-2-yl]benzamide.
What is the SMILES notation for N-[1-(4-hydroxyphenyl)-2-methylpropan-2-yl]benzamide?
The canonical SMILES for N-[1-(4-hydroxyphenyl)-2-methylpropan-2-yl]benzamide is CC(C)(Cc1ccc(O)cc1)NC(=O)c1ccccc1.
What is the InChIKey of N-[1-(4-hydroxyphenyl)-2-methylpropan-2-yl]benzamide?
The InChIKey is YLAMOOVOHCNTLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO2/c1-17(2,12-13-8-10-15(19)11-9-13)18-16(20)14-6-4-3-5-7-14/h3-11,19H,12H2,1-2H3,(H,18,20).
What are the key properties of N-[1-(4-hydroxyphenyl)-2-methylpropan-2-yl]benzamide?
N-[1-(4-hydroxyphenyl)-2-methylpropan-2-yl]benzamide has a molecular weight of 269.34 g/mol, XLogP of 3.14, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-hydroxyphenyl)-2-methylpropan-2-yl]benzamide is sourced from PubChem (CID 765444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).