ethane;N-methylacetamide;pent-2-yne;yttrium

C10H19NOY-2 — CID 161477728

IUPACethane;N-methylacetamide;pent-2-yne;yttrium
SMILESCNC(C)=O.[CH2-]C.[CH2-]CC#CC.[Y]
InChIInChI=1S/C5H7.C3H7NO.C2H5.Y/c1-3-5-4-2;1-3(5)4-2;1-2;/h1,3H2,2H3;1-2H3,(H,4,5);1H2,2H3;/q-1;;-1;
InChIKeyZUUAMNPNXPLZGQ-UHFFFAOYSA-N
MW258.17 g/mol
LogP1.82
Rot. Bonds

About ethane;N-methylacetamide;pent-2-yne;yttrium

ethane;N-methylacetamide;pent-2-yne;yttrium (PubChem CID 161477728) has the molecular formula C10H19NOY-2 and a molecular weight of 258.17 g/mol. Its IUPAC name is ethane;N-methylacetamide;pent-2-yne;yttrium.

Molecular Properties

Compound Nameethane;N-methylacetamide;pent-2-yne;yttrium
PubChem CID161477728
Molecular FormulaC10H19NOY-2
Molecular Weight258.17 g/mol
Exact Mass258.05
IUPAC Nameethane;N-methylacetamide;pent-2-yne;yttrium
SMILESCNC(C)=O.[CH2-]C.[CH2-]CC#CC.[Y]
InChIInChI=1S/C5H7.C3H7NO.C2H5.Y/c1-3-5-4-2;1-3(5)4-2;1-2;/h1,3H2,2H3;1-2H3,(H,4,5);1H2,2H3;/q-1;;-1;
InChIKeyZUUAMNPNXPLZGQ-UHFFFAOYSA-N
XLogP1.82
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.17
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of ethane;N-methylacetamide;pent-2-yne;yttrium?
The IUPAC name of ethane;N-methylacetamide;pent-2-yne;yttrium (CID 161477728) is ethane;N-methylacetamide;pent-2-yne;yttrium.
What is the SMILES notation for ethane;N-methylacetamide;pent-2-yne;yttrium?
The canonical SMILES for ethane;N-methylacetamide;pent-2-yne;yttrium is CNC(C)=O.[CH2-]C.[CH2-]CC#CC.[Y].
What is the InChIKey of ethane;N-methylacetamide;pent-2-yne;yttrium?
The InChIKey is ZUUAMNPNXPLZGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7.C3H7NO.C2H5.Y/c1-3-5-4-2;1-3(5)4-2;1-2;/h1,3H2,2H3;1-2H3,(H,4,5);1H2,2H3;/q-1;;-1;.
What are the key properties of ethane;N-methylacetamide;pent-2-yne;yttrium?
ethane;N-methylacetamide;pent-2-yne;yttrium has a molecular weight of 258.17 g/mol, XLogP of 1.82, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-methylacetamide;pent-2-yne;yttrium is sourced from PubChem (CID 161477728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).