aminophosphanyl 2,2-dimethylpropanimidate

C5H13N2OP — CID 163949509

IUPACaminophosphanyl 2,2-dimethylpropanimidate
SMILES[H]/N=C(\OPN)C(C)(C)C
InChIInChI=1S/C5H13N2OP/c1-5(2,3)4(6)8-9-7/h6,9H,7H2,1-3H3/b6-4-
InChIKeyRYBXGYUBDDUZBB-XQRVVYSFSA-N
MW148.15 g/mol
LogP1.49
Rot. Bonds1

About aminophosphanyl 2,2-dimethylpropanimidate

aminophosphanyl 2,2-dimethylpropanimidate (PubChem CID 163949509) has the molecular formula C5H13N2OP and a molecular weight of 148.15 g/mol. Its IUPAC name is aminophosphanyl 2,2-dimethylpropanimidate.

Molecular Properties

Compound Nameaminophosphanyl 2,2-dimethylpropanimidate
PubChem CID163949509
Molecular FormulaC5H13N2OP
Molecular Weight148.15 g/mol
Exact Mass148.08
IUPAC Nameaminophosphanyl 2,2-dimethylpropanimidate
SMILES[H]/N=C(\OPN)C(C)(C)C
InChIInChI=1S/C5H13N2OP/c1-5(2,3)4(6)8-9-7/h6,9H,7H2,1-3H3/b6-4-
InChIKeyRYBXGYUBDDUZBB-XQRVVYSFSA-N
XLogP1.49
TPSA59.10 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.15
LogP ≤ 51.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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

carbamoyl 2,2-dimethylpropanimidate
CID 144873528
2,2-dimethylpropanimidamide;hydrochloride
CID 2781880
2,2,5,5-tetramethylhexane-3,4-diimine
CID 21281613
(Z)-4-imino-3,5,5-trimethylhex-2-en-2-amine
CID 143962809
ethyl 2-methyl-2-methylsulfanylpropanimidate
CID 127002655
[N'-(2,2,2-trichloroethoxycarbonyl)carbamimidoyl] 2,2-dimethylpropanimidate
CID 123394028
N-[1-(dimethylamino)-2,2-dimethylpropylidene]-2,2-dimethylpropanimidamide
CID 167052160
methyl 2-chloro-2-methylbutanimidate
CID 118057274
azane;3,3-dimethylbutan-2-imine;hydrofluoride
CID 144859104
2,2-dimethylpropanediimidamide;dihydrochloride
CID 140977550
2,2-diaminopropanimidamide
CID 87520938
ethyl 2-imino-3,3-dimethylbutanoate
CID 134381367

Frequently Asked Questions

What is the IUPAC name of aminophosphanyl 2,2-dimethylpropanimidate?
The IUPAC name of aminophosphanyl 2,2-dimethylpropanimidate (CID 163949509) is aminophosphanyl 2,2-dimethylpropanimidate.
What is the SMILES notation for aminophosphanyl 2,2-dimethylpropanimidate?
The canonical SMILES for aminophosphanyl 2,2-dimethylpropanimidate is [H]/N=C(\OPN)C(C)(C)C.
What is the InChIKey of aminophosphanyl 2,2-dimethylpropanimidate?
The InChIKey is RYBXGYUBDDUZBB-XQRVVYSFSA-N. The full InChI is InChI=1S/C5H13N2OP/c1-5(2,3)4(6)8-9-7/h6,9H,7H2,1-3H3/b6-4-.
What are the key properties of aminophosphanyl 2,2-dimethylpropanimidate?
aminophosphanyl 2,2-dimethylpropanimidate has a molecular weight of 148.15 g/mol, XLogP of 1.49, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for aminophosphanyl 2,2-dimethylpropanimidate is sourced from PubChem (CID 163949509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).