carbanide;N-methyl-N-(3-methylbut-2-en-2-yl)acetamide;yttrium

C9H18NOY- — CID 169427082

IUPACcarbanide;N-methyl-N-(3-methylbut-2-en-2-yl)acetamide;yttrium
SMILESCC(=O)N(C)C(C)=C(C)C.[CH3-].[Y]
InChIInChI=1S/C8H15NO.CH3.Y/c1-6(2)7(3)9(5)8(4)10;;/h1-5H3;1H3;/q;-1;
InChIKeyZCFZCUQRRUTCBW-UHFFFAOYSA-N
MW245.15 g/mol
LogP2.23
Rot. Bonds1

About carbanide;N-methyl-N-(3-methylbut-2-en-2-yl)acetamide;yttrium

carbanide;N-methyl-N-(3-methylbut-2-en-2-yl)acetamide;yttrium (PubChem CID 169427082) has the molecular formula C9H18NOY- and a molecular weight of 245.15 g/mol. Its IUPAC name is carbanide;N-methyl-N-(3-methylbut-2-en-2-yl)acetamide;yttrium.

Molecular Properties

Compound Namecarbanide;N-methyl-N-(3-methylbut-2-en-2-yl)acetamide;yttrium
PubChem CID169427082
Molecular FormulaC9H18NOY-
Molecular Weight245.15 g/mol
Exact Mass245.05
IUPAC Namecarbanide;N-methyl-N-(3-methylbut-2-en-2-yl)acetamide;yttrium
SMILESCC(=O)N(C)C(C)=C(C)C.[CH3-].[Y]
InChIInChI=1S/C8H15NO.CH3.Y/c1-6(2)7(3)9(5)8(4)10;;/h1-5H3;1H3;/q;-1;
InChIKeyZCFZCUQRRUTCBW-UHFFFAOYSA-N
XLogP2.23
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.15
LogP ≤ 52.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of carbanide;N-methyl-N-(3-methylbut-2-en-2-yl)acetamide;yttrium?
The IUPAC name of carbanide;N-methyl-N-(3-methylbut-2-en-2-yl)acetamide;yttrium (CID 169427082) is carbanide;N-methyl-N-(3-methylbut-2-en-2-yl)acetamide;yttrium.
What is the SMILES notation for carbanide;N-methyl-N-(3-methylbut-2-en-2-yl)acetamide;yttrium?
The canonical SMILES for carbanide;N-methyl-N-(3-methylbut-2-en-2-yl)acetamide;yttrium is CC(=O)N(C)C(C)=C(C)C.[CH3-].[Y].
What is the InChIKey of carbanide;N-methyl-N-(3-methylbut-2-en-2-yl)acetamide;yttrium?
The InChIKey is ZCFZCUQRRUTCBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO.CH3.Y/c1-6(2)7(3)9(5)8(4)10;;/h1-5H3;1H3;/q;-1;.
What are the key properties of carbanide;N-methyl-N-(3-methylbut-2-en-2-yl)acetamide;yttrium?
carbanide;N-methyl-N-(3-methylbut-2-en-2-yl)acetamide;yttrium has a molecular weight of 245.15 g/mol, XLogP of 2.23, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;N-methyl-N-(3-methylbut-2-en-2-yl)acetamide;yttrium is sourced from PubChem (CID 169427082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).