ethane;methyl(2-methylbutanoyl)azanide;yttrium

C8H18NOY- — CID 177048514

IUPACethane;methyl(2-methylbutanoyl)azanide;yttrium
SMILESCC.CCC(C)C(=O)[N-]C.[Y]
InChIInChI=1S/C6H13NO.C2H6.Y/c1-4-5(2)6(8)7-3;1-2;/h5H,4H2,1-3H3,(H,7,8);1-2H3;/p-1
InChIKeyCASBULOBXQJCIU-UHFFFAOYSA-M
MW233.14 g/mol
LogP2.59
Rot. Bonds2

About ethane;methyl(2-methylbutanoyl)azanide;yttrium

ethane;methyl(2-methylbutanoyl)azanide;yttrium (PubChem CID 177048514) has the molecular formula C8H18NOY- and a molecular weight of 233.14 g/mol. Its IUPAC name is ethane;methyl(2-methylbutanoyl)azanide;yttrium.

Molecular Properties

Compound Nameethane;methyl(2-methylbutanoyl)azanide;yttrium
PubChem CID177048514
Molecular FormulaC8H18NOY-
Molecular Weight233.14 g/mol
Exact Mass233.05
IUPAC Nameethane;methyl(2-methylbutanoyl)azanide;yttrium
SMILESCC.CCC(C)C(=O)[N-]C.[Y]
InChIInChI=1S/C6H13NO.C2H6.Y/c1-4-5(2)6(8)7-3;1-2;/h5H,4H2,1-3H3,(H,7,8);1-2H3;/p-1
InChIKeyCASBULOBXQJCIU-UHFFFAOYSA-M
XLogP2.59
TPSA31.17 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.14
LogP ≤ 52.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

methylaminomethanone;methyl-[(2S)-2-methylbutanoyl]azanide;yttrium
CID 59978114
ethane;2-methylbutanoic acid
CID 87621166
magnesium bis(2-methylbutanoate)
CID 88739715
ethane;N-ethyl-2-methylbutanamide
CID 145471862
2-methylbutanoylcarbamic acid
CID 87928192
ethane;ethyl 2-methylbutanoate
CID 144747106
ethane;methyl (2R)-2-methylbutanoate
CID 143689114
2-methylbutanoate
CID 91073357
CID 88513173
CID 88513173
bis(2-methylbutanoic acid);nickel
CID 170549792
methane;(2S)-2-methylbutanoic acid
CID 159302978
iron;2-methylbutanoic acid
CID 175205801

Frequently Asked Questions

What is the IUPAC name of ethane;methyl(2-methylbutanoyl)azanide;yttrium?
The IUPAC name of ethane;methyl(2-methylbutanoyl)azanide;yttrium (CID 177048514) is ethane;methyl(2-methylbutanoyl)azanide;yttrium.
What is the SMILES notation for ethane;methyl(2-methylbutanoyl)azanide;yttrium?
The canonical SMILES for ethane;methyl(2-methylbutanoyl)azanide;yttrium is CC.CCC(C)C(=O)[N-]C.[Y].
What is the InChIKey of ethane;methyl(2-methylbutanoyl)azanide;yttrium?
The InChIKey is CASBULOBXQJCIU-UHFFFAOYSA-M. The full InChI is InChI=1S/C6H13NO.C2H6.Y/c1-4-5(2)6(8)7-3;1-2;/h5H,4H2,1-3H3,(H,7,8);1-2H3;/p-1.
What are the key properties of ethane;methyl(2-methylbutanoyl)azanide;yttrium?
ethane;methyl(2-methylbutanoyl)azanide;yttrium has a molecular weight of 233.14 g/mol, XLogP of 2.59, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;methyl(2-methylbutanoyl)azanide;yttrium is sourced from PubChem (CID 177048514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).