N-(5-dimethylphosphoryl-2-pyridinyl)acetamide

C9H13N2O2P — CID 59649348

IUPACN-(5-dimethylphosphoryl-2-pyridinyl)acetamide
SMILESCC(=O)Nc1ccc(P(C)(C)=O)cn1
InChIInChI=1S/C9H13N2O2P/c1-7(12)11-9-5-4-8(6-10-9)14(2,3)13/h4-6H,1-3H3,(H,10,11,12)
InChIKeyYCXMUCWOQYHITF-UHFFFAOYSA-N
MW212.19 g/mol
LogP1.29
Rot. Bonds2

About N-(5-dimethylphosphoryl-2-pyridinyl)acetamide

N-(5-dimethylphosphoryl-2-pyridinyl)acetamide (PubChem CID 59649348) has the molecular formula C9H13N2O2P and a molecular weight of 212.19 g/mol. Its IUPAC name is N-(5-dimethylphosphoryl-2-pyridinyl)acetamide.

Molecular Properties

Compound NameN-(5-dimethylphosphoryl-2-pyridinyl)acetamide
PubChem CID59649348
Molecular FormulaC9H13N2O2P
Molecular Weight212.19 g/mol
Exact Mass212.07
IUPAC NameN-(5-dimethylphosphoryl-2-pyridinyl)acetamide
SMILESCC(=O)Nc1ccc(P(C)(C)=O)cn1
InChIInChI=1S/C9H13N2O2P/c1-7(12)11-9-5-4-8(6-10-9)14(2,3)13/h4-6H,1-3H3,(H,10,11,12)
InChIKeyYCXMUCWOQYHITF-UHFFFAOYSA-N
XLogP1.29
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.19
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(5-sulfanyl-2-pyridinyl)acetamide
CID 67482224
6-acetamidopyridine-3-sulfonic acid
CID 3292774
N-[5-(2-hydroxyacetyl)-2-pyridinyl]acetamide
CID 15512450
N-(5-pyridin-4-yl-2-pyridinyl)acetamide
CID 102057434
N-[5-[(1R)-1-aminoprop-2-enyl]-2-pyridinyl]acetamide
CID 55274663
N-[5-[(1S)-1-aminoprop-2-enyl]-2-pyridinyl]acetamide
CID 130955914
ethane;N-[5-(4-methylphenyl)-2-pyridinyl]acetamide;molecular hydrogen
CID 145105834
N-[5-(1-methoxyethyl)-2-pyridinyl]acetamide
CID 163950546
N-[5-[(1S)-1-hydroxypropyl]-2-pyridinyl]acetamide
CID 54369170
3-[(6-acetamido-3-pyridinyl)carbamoyl]pyrazine-2-carboxylic acid
CID 2813206
N-[5-[(E)-2-(6-formamido-3-pyridinyl)ethenyl]-2-pyridinyl]acetamide
CID 134421519
methyl (E)-3-(6-acetamido-3-pyridinyl)prop-2-enoate
CID 86754877

Frequently Asked Questions

What is the IUPAC name of N-(5-dimethylphosphoryl-2-pyridinyl)acetamide?
The IUPAC name of N-(5-dimethylphosphoryl-2-pyridinyl)acetamide (CID 59649348) is N-(5-dimethylphosphoryl-2-pyridinyl)acetamide.
What is the SMILES notation for N-(5-dimethylphosphoryl-2-pyridinyl)acetamide?
The canonical SMILES for N-(5-dimethylphosphoryl-2-pyridinyl)acetamide is CC(=O)Nc1ccc(P(C)(C)=O)cn1.
What is the InChIKey of N-(5-dimethylphosphoryl-2-pyridinyl)acetamide?
The InChIKey is YCXMUCWOQYHITF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N2O2P/c1-7(12)11-9-5-4-8(6-10-9)14(2,3)13/h4-6H,1-3H3,(H,10,11,12).
What are the key properties of N-(5-dimethylphosphoryl-2-pyridinyl)acetamide?
N-(5-dimethylphosphoryl-2-pyridinyl)acetamide has a molecular weight of 212.19 g/mol, XLogP of 1.29, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-dimethylphosphoryl-2-pyridinyl)acetamide is sourced from PubChem (CID 59649348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).