acetyl(1,1-diphenylethyl)azanide;yttrium

C16H16NOY- — CID 58647027

IUPACacetyl(1,1-diphenylethyl)azanide;yttrium
SMILESCC(=O)[N-]C(C)(c1ccccc1)c1ccccc1.[Y]
InChIInChI=1S/C16H17NO.Y/c1-13(18)17-16(2,14-9-5-3-6-10-14)15-11-7-4-8-12-15;/h3-12H,1-2H3,(H,17,18);/p-1
InChIKeyAHALTWBWJAQWOZ-UHFFFAOYSA-M
MW327.22 g/mol
LogP3.87
Rot. Bonds3

About acetyl(1,1-diphenylethyl)azanide;yttrium

acetyl(1,1-diphenylethyl)azanide;yttrium (PubChem CID 58647027) has the molecular formula C16H16NOY- and a molecular weight of 327.22 g/mol. Its IUPAC name is acetyl(1,1-diphenylethyl)azanide;yttrium.

Molecular Properties

Compound Nameacetyl(1,1-diphenylethyl)azanide;yttrium
PubChem CID58647027
Molecular FormulaC16H16NOY-
Molecular Weight327.22 g/mol
Exact Mass327.03
IUPAC Nameacetyl(1,1-diphenylethyl)azanide;yttrium
SMILESCC(=O)[N-]C(C)(c1ccccc1)c1ccccc1.[Y]
InChIInChI=1S/C16H17NO.Y/c1-13(18)17-16(2,14-9-5-3-6-10-14)15-11-7-4-8-12-15;/h3-12H,1-2H3,(H,17,18);/p-1
InChIKeyAHALTWBWJAQWOZ-UHFFFAOYSA-M
XLogP3.87
TPSA31.17 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.22
LogP ≤ 53.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(2R)-2-hydroxy-2-phenylpropanoic acid
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ethane;2-hydroxy-2,2-diphenylacetic acid
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(3-acetyloxy-2,3-diphenylbutan-2-yl) acetate
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[(1S)-1-hydroxy-1-phenylethyl]sulfanylformic acid
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1,1-diphenylethyl carbamate
CID 20976713
N-[(2R)-2-phenylbutan-2-yl]acetamide
CID 101079586
ethane;2-phenylpropan-2-ylbenzene;acetate
CID 167579549
magnesium;hydride;2-methyl-2-phenylpropanoic acid
CID 174669783
(2R)-3-methyl-2-phenylbut-3-en-2-ol
CID 102163421
3-amino-3-phenylpentane-2,4-dione
CID 70119036
aluminum;(2-methyl-2-phenylpropyl) acetate;trichloride
CID 68741763

Frequently Asked Questions

What is the IUPAC name of acetyl(1,1-diphenylethyl)azanide;yttrium?
The IUPAC name of acetyl(1,1-diphenylethyl)azanide;yttrium (CID 58647027) is acetyl(1,1-diphenylethyl)azanide;yttrium.
What is the SMILES notation for acetyl(1,1-diphenylethyl)azanide;yttrium?
The canonical SMILES for acetyl(1,1-diphenylethyl)azanide;yttrium is CC(=O)[N-]C(C)(c1ccccc1)c1ccccc1.[Y].
What is the InChIKey of acetyl(1,1-diphenylethyl)azanide;yttrium?
The InChIKey is AHALTWBWJAQWOZ-UHFFFAOYSA-M. The full InChI is InChI=1S/C16H17NO.Y/c1-13(18)17-16(2,14-9-5-3-6-10-14)15-11-7-4-8-12-15;/h3-12H,1-2H3,(H,17,18);/p-1.
What are the key properties of acetyl(1,1-diphenylethyl)azanide;yttrium?
acetyl(1,1-diphenylethyl)azanide;yttrium has a molecular weight of 327.22 g/mol, XLogP of 3.87, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for acetyl(1,1-diphenylethyl)azanide;yttrium is sourced from PubChem (CID 58647027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).