N-(2-aminophenyl)acetamide;2-methanidylpropane;vanadium(2+)

C12H18N2OV — CID 153457478

IUPACN-(2-aminophenyl)acetamide;2-methanidylpropane;vanadium(2+)
SMILES[CH2-]C(=O)Nc1ccccc1N.[CH2-]C(C)C.[V+2]
InChIInChI=1S/C8H9N2O.C4H9.V/c1-6(11)10-8-5-3-2-4-7(8)9;1-4(2)3;/h2-5H,1,9H2,(H,10,11);4H,1H2,2-3H3;/q2*-1;+2
InChIKeyIQCUPMHWCVBCFI-UHFFFAOYSA-N
MW257.23 g/mol
LogP2.52
Rot. Bonds1

About N-(2-aminophenyl)acetamide;2-methanidylpropane;vanadium(2+)

N-(2-aminophenyl)acetamide;2-methanidylpropane;vanadium(2+) (PubChem CID 153457478) has the molecular formula C12H18N2OV and a molecular weight of 257.23 g/mol. Its IUPAC name is N-(2-aminophenyl)acetamide;2-methanidylpropane;vanadium(2+).

Molecular Properties

Compound NameN-(2-aminophenyl)acetamide;2-methanidylpropane;vanadium(2+)
PubChem CID153457478
Molecular FormulaC12H18N2OV
Molecular Weight257.23 g/mol
Exact Mass257.09
IUPAC NameN-(2-aminophenyl)acetamide;2-methanidylpropane;vanadium(2+)
SMILES[CH2-]C(=O)Nc1ccccc1N.[CH2-]C(C)C.[V+2]
InChIInChI=1S/C8H9N2O.C4H9.V/c1-6(11)10-8-5-3-2-4-7(8)9;1-4(2)3;/h2-5H,1,9H2,(H,10,11);4H,1H2,2-3H3;/q2*-1;+2
InChIKeyIQCUPMHWCVBCFI-UHFFFAOYSA-N
XLogP2.52
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.23
LogP ≤ 52.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(2-aminophenyl)acetamide;N-(2-aminophenyl)-6-methylheptanamide;2-methanidylpropane;vanadium(2+)
CID 163795898
(2R)-2-amino-N-(2-aminophenyl)propanamide;hydrochloride
CID 131153716
N-(2-aminophenyl)-1-phosphanylformamide;ethane
CID 90955856
2-methylpropyl N-(2-aminophenyl)carbamate
CID 43185966
(E)-N-(2-aminophenyl)-4-methylpent-2-enamide
CID 59715941
[1-(2-aminoanilino)-1-oxopropan-2-yl] acetate
CID 167409598
2-(2-aminoanilino)propanoic acid
CID 67237083
N-(2-aminophenyl)-2-ethylsulfinylpropanamide
CID 61303245
1-(2-aminophenyl)-3-iodourea
CID 130470631
N-(2-aminophenyl)-3-ethylpentanamide
CID 119422237
N-(2-aminophenyl)but-2-ynamide
CID 90330903
N-(2-aminophenyl)-2-(oxetan-3-ylsulfanyl)propanamide
CID 79326942

Frequently Asked Questions

What is the IUPAC name of N-(2-aminophenyl)acetamide;2-methanidylpropane;vanadium(2+)?
The IUPAC name of N-(2-aminophenyl)acetamide;2-methanidylpropane;vanadium(2+) (CID 153457478) is N-(2-aminophenyl)acetamide;2-methanidylpropane;vanadium(2+).
What is the SMILES notation for N-(2-aminophenyl)acetamide;2-methanidylpropane;vanadium(2+)?
The canonical SMILES for N-(2-aminophenyl)acetamide;2-methanidylpropane;vanadium(2+) is [CH2-]C(=O)Nc1ccccc1N.[CH2-]C(C)C.[V+2].
What is the InChIKey of N-(2-aminophenyl)acetamide;2-methanidylpropane;vanadium(2+)?
The InChIKey is IQCUPMHWCVBCFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N2O.C4H9.V/c1-6(11)10-8-5-3-2-4-7(8)9;1-4(2)3;/h2-5H,1,9H2,(H,10,11);4H,1H2,2-3H3;/q2*-1;+2.
What are the key properties of N-(2-aminophenyl)acetamide;2-methanidylpropane;vanadium(2+)?
N-(2-aminophenyl)acetamide;2-methanidylpropane;vanadium(2+) has a molecular weight of 257.23 g/mol, XLogP of 2.52, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminophenyl)acetamide;2-methanidylpropane;vanadium(2+) is sourced from PubChem (CID 153457478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).