(Z)-N,4-dimethyl-2-phosphanylhex-4-en-3-imine

C8H16NP — CID 123698347

IUPAC(Z)-N,4-dimethyl-2-phosphanylhex-4-en-3-imine
SMILESC/C=C(C)\C(=N\C)C(C)P
InChIInChI=1S/C8H16NP/c1-5-6(2)8(9-4)7(3)10/h5,7H,10H2,1-4H3/b6-5-,9-8-
InChIKeyCWLPIGSMYGXPSV-AFJQJTPPSA-N
MW157.20 g/mol
LogP2.29
Rot. Bonds2

About (Z)-N,4-dimethyl-2-phosphanylhex-4-en-3-imine

(Z)-N,4-dimethyl-2-phosphanylhex-4-en-3-imine (PubChem CID 123698347) has the molecular formula C8H16NP and a molecular weight of 157.20 g/mol. Its IUPAC name is (Z)-N,4-dimethyl-2-phosphanylhex-4-en-3-imine.

Molecular Properties

Compound Name(Z)-N,4-dimethyl-2-phosphanylhex-4-en-3-imine
PubChem CID123698347
Molecular FormulaC8H16NP
Molecular Weight157.20 g/mol
Exact Mass157.10
IUPAC Name(Z)-N,4-dimethyl-2-phosphanylhex-4-en-3-imine
SMILESC/C=C(C)\C(=N\C)C(C)P
InChIInChI=1S/C8H16NP/c1-5-6(2)8(9-4)7(3)10/h5,7H,10H2,1-4H3/b6-5-,9-8-
InChIKeyCWLPIGSMYGXPSV-AFJQJTPPSA-N
XLogP2.29
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.20
LogP ≤ 52.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (Z)-N,4-dimethyl-2-phosphanylhex-4-en-3-imine?
The IUPAC name of (Z)-N,4-dimethyl-2-phosphanylhex-4-en-3-imine (CID 123698347) is (Z)-N,4-dimethyl-2-phosphanylhex-4-en-3-imine.
What is the SMILES notation for (Z)-N,4-dimethyl-2-phosphanylhex-4-en-3-imine?
The canonical SMILES for (Z)-N,4-dimethyl-2-phosphanylhex-4-en-3-imine is C/C=C(C)\C(=N\C)C(C)P.
What is the InChIKey of (Z)-N,4-dimethyl-2-phosphanylhex-4-en-3-imine?
The InChIKey is CWLPIGSMYGXPSV-AFJQJTPPSA-N. The full InChI is InChI=1S/C8H16NP/c1-5-6(2)8(9-4)7(3)10/h5,7H,10H2,1-4H3/b6-5-,9-8-.
What are the key properties of (Z)-N,4-dimethyl-2-phosphanylhex-4-en-3-imine?
(Z)-N,4-dimethyl-2-phosphanylhex-4-en-3-imine has a molecular weight of 157.20 g/mol, XLogP of 2.29, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N,4-dimethyl-2-phosphanylhex-4-en-3-imine is sourced from PubChem (CID 123698347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).