dioxomolybdenum;N-(2-hydroxyethyl)-N-propylacetamide

C7H14MoNO4- — CID 58446045

IUPACdioxomolybdenum;N-(2-hydroxyethyl)-N-propylacetamide
SMILESO=[Mo]=O.[CH2-]CCN(CCO)C(C)=O
InChIInChI=1S/C7H14NO2.Mo.2O/c1-3-4-8(5-6-9)7(2)10;;;/h9H,1,3-6H2,2H3;;;/q-1;;;
InChIKeyXPHYVGJKHNNYDT-UHFFFAOYSA-N
MW272.13 g/mol
LogP-0.19
Rot. Bonds4

About dioxomolybdenum;N-(2-hydroxyethyl)-N-propylacetamide

dioxomolybdenum;N-(2-hydroxyethyl)-N-propylacetamide (PubChem CID 58446045) has the molecular formula C7H14MoNO4- and a molecular weight of 272.13 g/mol. Its IUPAC name is dioxomolybdenum;N-(2-hydroxyethyl)-N-propylacetamide.

Molecular Properties

Compound Namedioxomolybdenum;N-(2-hydroxyethyl)-N-propylacetamide
PubChem CID58446045
Molecular FormulaC7H14MoNO4-
Molecular Weight272.13 g/mol
Exact Mass274.00
IUPAC Namedioxomolybdenum;N-(2-hydroxyethyl)-N-propylacetamide
SMILESO=[Mo]=O.[CH2-]CCN(CCO)C(C)=O
InChIInChI=1S/C7H14NO2.Mo.2O/c1-3-4-8(5-6-9)7(2)10;;;/h9H,1,3-6H2,2H3;;;/q-1;;;
InChIKeyXPHYVGJKHNNYDT-UHFFFAOYSA-N
XLogP-0.19
TPSA74.68 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.13
LogP ≤ 5-0.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

ethane;N-(2-hydroxyethyl)-N-(2-methylpropyl)acetamide
CID 177048994
N-(2-hydroxyethyl)-N-prop-2-enylacetamide
CID 84572947
ethyl(2-hydroxyethyl)carbamic acid
CID 23202017
N,N-di(icosyl)acetamide
CID 57063838
N-heptadecyl-N-tridecylacetamide
CID 172567567
N,N-di(pentadecyl)acetamide
CID 174726671
N,N-bis(2-hydroxyethyl)butanamide
CID 14455174
N,N-bis(2-hydroxyethyl)-2-methylprop-2-enamide;2-methylprop-2-enamide
CID 175383713
N-(2-bromoethyl)-N-propylacetamide
CID 80660131
N-butyl-N-heptylacetamide
CID 91713167
N-(2-hydroxyethyl)-N-[3-[2-hydroxyethyl(propanoyl)amino]propyl]propanamide
CID 20740586
N-[3-(methylamino)propyl]-N-propylacetamide
CID 130231961

Frequently Asked Questions

What is the IUPAC name of dioxomolybdenum;N-(2-hydroxyethyl)-N-propylacetamide?
The IUPAC name of dioxomolybdenum;N-(2-hydroxyethyl)-N-propylacetamide (CID 58446045) is dioxomolybdenum;N-(2-hydroxyethyl)-N-propylacetamide.
What is the SMILES notation for dioxomolybdenum;N-(2-hydroxyethyl)-N-propylacetamide?
The canonical SMILES for dioxomolybdenum;N-(2-hydroxyethyl)-N-propylacetamide is O=[Mo]=O.[CH2-]CCN(CCO)C(C)=O.
What is the InChIKey of dioxomolybdenum;N-(2-hydroxyethyl)-N-propylacetamide?
The InChIKey is XPHYVGJKHNNYDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14NO2.Mo.2O/c1-3-4-8(5-6-9)7(2)10;;;/h9H,1,3-6H2,2H3;;;/q-1;;;.
What are the key properties of dioxomolybdenum;N-(2-hydroxyethyl)-N-propylacetamide?
dioxomolybdenum;N-(2-hydroxyethyl)-N-propylacetamide has a molecular weight of 272.13 g/mol, XLogP of -0.19, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for dioxomolybdenum;N-(2-hydroxyethyl)-N-propylacetamide is sourced from PubChem (CID 58446045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).