N'-diethylphosphanylbenzenecarboximidamide

C11H17N2P — CID 175989324

IUPACN'-diethylphosphanylbenzenecarboximidamide
SMILESCCP(CC)N=C(N)c1ccccc1
InChIInChI=1S/C11H17N2P/c1-3-14(4-2)13-11(12)10-8-6-5-7-9-10/h5-9H,3-4H2,1-2H3,(H2,12,13)
InChIKeyXVIFTCUPAMNQPC-UHFFFAOYSA-N
MW208.25 g/mol
LogP2.83
Rot. Bonds4

About N'-diethylphosphanylbenzenecarboximidamide

N'-diethylphosphanylbenzenecarboximidamide (PubChem CID 175989324) has the molecular formula C11H17N2P and a molecular weight of 208.25 g/mol. Its IUPAC name is N'-diethylphosphanylbenzenecarboximidamide.

Molecular Properties

Compound NameN'-diethylphosphanylbenzenecarboximidamide
PubChem CID175989324
Molecular FormulaC11H17N2P
Molecular Weight208.25 g/mol
Exact Mass208.11
IUPAC NameN'-diethylphosphanylbenzenecarboximidamide
SMILESCCP(CC)N=C(N)c1ccccc1
InChIInChI=1S/C11H17N2P/c1-3-14(4-2)13-11(12)10-8-6-5-7-9-10/h5-9H,3-4H2,1-2H3,(H2,12,13)
InChIKeyXVIFTCUPAMNQPC-UHFFFAOYSA-N
XLogP2.83
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.25
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

N'-(ethylamino)benzenecarboximidamide;hydroiodide
CID 143177355
N'-butan-2-ylbenzenecarboximidamide
CID 63174298
N'-[(E)-butan-2-ylideneamino]benzenecarboximidamide
CID 23272403
N'-hydroxybenzenecarboximidamide
CID 142861747
N'-aminobenzenecarboximidamide
CID 5474957
ethene;N'-methylbenzenecarboximidamide
CID 142294327
benzenecarboximidamide;propanoic acid
CID 159833627
N'-[(Z)-1-phenylbut-1-enyl]benzenecarboximidamide
CID 145334764
[(Z)-[amino(phenyl)methylidene]amino] propanoate
CID 12649620
N'-hydroxybenzenecarboximidamide;pentahydrate
CID 174367022
N'-methoxybenzenecarboximidamide
CID 10678407
N'-[3-[[amino(phenyl)methylidene]amino]propyl]benzenecarboximidamide
CID 132564986

Frequently Asked Questions

What is the IUPAC name of N'-diethylphosphanylbenzenecarboximidamide?
The IUPAC name of N'-diethylphosphanylbenzenecarboximidamide (CID 175989324) is N'-diethylphosphanylbenzenecarboximidamide.
What is the SMILES notation for N'-diethylphosphanylbenzenecarboximidamide?
The canonical SMILES for N'-diethylphosphanylbenzenecarboximidamide is CCP(CC)N=C(N)c1ccccc1.
What is the InChIKey of N'-diethylphosphanylbenzenecarboximidamide?
The InChIKey is XVIFTCUPAMNQPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N2P/c1-3-14(4-2)13-11(12)10-8-6-5-7-9-10/h5-9H,3-4H2,1-2H3,(H2,12,13).
What are the key properties of N'-diethylphosphanylbenzenecarboximidamide?
N'-diethylphosphanylbenzenecarboximidamide has a molecular weight of 208.25 g/mol, XLogP of 2.83, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-diethylphosphanylbenzenecarboximidamide is sourced from PubChem (CID 175989324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).