(Z)-3-iodo-N-methyl-1,2-bis(phosphanyl)but-2-en-1-imine

C5H10INP2 — CID 144680139

IUPAC(Z)-3-iodo-N-methyl-1,2-bis(phosphanyl)but-2-en-1-imine
SMILESC/N=C(P)/C(P)=C(\C)I
InChIInChI=1S/C5H10INP2/c1-3(6)4(8)5(9)7-2/h8-9H2,1-2H3/b4-3-,7-5-
InChIKeySYEVPYFRFLNZCV-MRWCJKGFSA-N
MW272.99 g/mol
LogP2.43
Rot. Bonds1

About (Z)-3-iodo-N-methyl-1,2-bis(phosphanyl)but-2-en-1-imine

(Z)-3-iodo-N-methyl-1,2-bis(phosphanyl)but-2-en-1-imine (PubChem CID 144680139) has the molecular formula C5H10INP2 and a molecular weight of 272.99 g/mol. Its IUPAC name is (Z)-3-iodo-N-methyl-1,2-bis(phosphanyl)but-2-en-1-imine.

Molecular Properties

Compound Name(Z)-3-iodo-N-methyl-1,2-bis(phosphanyl)but-2-en-1-imine
PubChem CID144680139
Molecular FormulaC5H10INP2
Molecular Weight272.99 g/mol
Exact Mass272.93
IUPAC Name(Z)-3-iodo-N-methyl-1,2-bis(phosphanyl)but-2-en-1-imine
SMILESC/N=C(P)/C(P)=C(\C)I
InChIInChI=1S/C5H10INP2/c1-3(6)4(8)5(9)7-2/h8-9H2,1-2H3/b4-3-,7-5-
InChIKeySYEVPYFRFLNZCV-MRWCJKGFSA-N
XLogP2.43
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.99
LogP ≤ 52.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-(C,N-dimethylcarbonimidoyl)ethanimidoyl iodide
CID 135129023
(Z)-3-fluoro-4-iodo-2-methyliminopent-3-en-1-amine
CID 167170110
N-hydroxyethanimidoyl iodide
CID 173361883
N-methyl-1-phosphanylpropan-2-imine
CID 123219602
2-N,3-N-dimethylbutane-2,3-diimine;hydrogen peroxide;nickel
CID 20647692
N'-methylethanimidamide;vanadium
CID 161014708
2-methylbut-2-ene;N-methylpropan-2-imine
CID 161325778
N-(1-methoxyethylamino)-N'-methylethanimidamide
CID 146533561
(E)-2,3-diiodobut-2-en-1-ol
CID 53376977
N'-methyl-N-propan-2-ylideneethanimidamide
CID 158478143
N'-hydroxyethanimidamide;N'-methylethanimidamide
CID 172976060
(Z)-3-ethyl-4-methyliminopent-2-en-2-amine
CID 143420792

Frequently Asked Questions

What is the IUPAC name of (Z)-3-iodo-N-methyl-1,2-bis(phosphanyl)but-2-en-1-imine?
The IUPAC name of (Z)-3-iodo-N-methyl-1,2-bis(phosphanyl)but-2-en-1-imine (CID 144680139) is (Z)-3-iodo-N-methyl-1,2-bis(phosphanyl)but-2-en-1-imine.
What is the SMILES notation for (Z)-3-iodo-N-methyl-1,2-bis(phosphanyl)but-2-en-1-imine?
The canonical SMILES for (Z)-3-iodo-N-methyl-1,2-bis(phosphanyl)but-2-en-1-imine is C/N=C(P)/C(P)=C(\C)I.
What is the InChIKey of (Z)-3-iodo-N-methyl-1,2-bis(phosphanyl)but-2-en-1-imine?
The InChIKey is SYEVPYFRFLNZCV-MRWCJKGFSA-N. The full InChI is InChI=1S/C5H10INP2/c1-3(6)4(8)5(9)7-2/h8-9H2,1-2H3/b4-3-,7-5-.
What are the key properties of (Z)-3-iodo-N-methyl-1,2-bis(phosphanyl)but-2-en-1-imine?
(Z)-3-iodo-N-methyl-1,2-bis(phosphanyl)but-2-en-1-imine has a molecular weight of 272.99 g/mol, XLogP of 2.43, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-iodo-N-methyl-1,2-bis(phosphanyl)but-2-en-1-imine is sourced from PubChem (CID 144680139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).