N-[(E)-[(2Z)-2-ethylidene-6-phosphanylcyclohexylidene]methyl]methanimine

C10H16NP — CID 143214136

IUPACN-[(E)-[(2Z)-2-ethylidene-6-phosphanylcyclohexylidene]methyl]methanimine
SMILESC=N/C=C1C(=C/C)\CCCC\1P
InChIInChI=1S/C10H16NP/c1-3-8-5-4-6-10(12)9(8)7-11-2/h3,7,10H,2,4-6,12H2,1H3/b8-3-,9-7+
InChIKeySZWKIAZGTIWPFG-HESJCCPHSA-N
MW181.22 g/mol
LogP2.94
Rot. Bonds1

About N-[(E)-[(2Z)-2-ethylidene-6-phosphanylcyclohexylidene]methyl]methanimine

N-[(E)-[(2Z)-2-ethylidene-6-phosphanylcyclohexylidene]methyl]methanimine (PubChem CID 143214136) has the molecular formula C10H16NP and a molecular weight of 181.22 g/mol. Its IUPAC name is N-[(E)-[(2Z)-2-ethylidene-6-phosphanylcyclohexylidene]methyl]methanimine.

Molecular Properties

Compound NameN-[(E)-[(2Z)-2-ethylidene-6-phosphanylcyclohexylidene]methyl]methanimine
PubChem CID143214136
Molecular FormulaC10H16NP
Molecular Weight181.22 g/mol
Exact Mass181.10
IUPAC NameN-[(E)-[(2Z)-2-ethylidene-6-phosphanylcyclohexylidene]methyl]methanimine
SMILESC=N/C=C1C(=C/C)\CCCC\1P
InChIInChI=1S/C10H16NP/c1-3-8-5-4-6-10(12)9(8)7-11-2/h3,7,10H,2,4-6,12H2,1H3/b8-3-,9-7+
InChIKeySZWKIAZGTIWPFG-HESJCCPHSA-N
XLogP2.94
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.22
LogP ≤ 52.94
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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Related Compounds

ethane;(1Z,2Z)-1-ethylidene-3-methyl-2-prop-2-enylidenecyclohexane
CID 157035804
(1E,2Z)-1,2-di(ethylidene)cyclohexane
CID 102070913
(2E,3Z)-2,3-di(ethylidene)-6-phosphanylcyclohexan-1-amine;ethane;ethene
CID 142832926
1-[(1S,2Z,3Z)-3-ethylidene-2-prop-2-enylidenecyclohexyl]ethanone
CID 143932314
1,2-di(ethylidene)cyclooctane
CID 134898176
(1E)-1-ethylidene-2-methylidenecyclopentane
CID 142947641
(2E,6Z)-2,6-di(ethylidene)-N-methylcyclohexan-1-imine;ethane
CID 153388202
2-ethylidenecyclopentan-1-ol
CID 72740887
tert-butyl N-[(3Z)-3-ethylidene-2-methylidenecyclohexyl]carbamate
CID 118155899
1-ethylidene-2-prop-2-enylidenecyclooctane
CID 91407681
ethane;(1Z,2Z)-1-ethylidene-3-propan-2-yl-2-prop-2-enylidenecyclopentane
CID 157035822
N-[(1S,2E,3Z)-3-ethylidene-2-prop-2-enylidenecyclohexyl]-N-methylbenzamide
CID 143175426

Frequently Asked Questions

What is the IUPAC name of N-[(E)-[(2Z)-2-ethylidene-6-phosphanylcyclohexylidene]methyl]methanimine?
The IUPAC name of N-[(E)-[(2Z)-2-ethylidene-6-phosphanylcyclohexylidene]methyl]methanimine (CID 143214136) is N-[(E)-[(2Z)-2-ethylidene-6-phosphanylcyclohexylidene]methyl]methanimine.
What is the SMILES notation for N-[(E)-[(2Z)-2-ethylidene-6-phosphanylcyclohexylidene]methyl]methanimine?
The canonical SMILES for N-[(E)-[(2Z)-2-ethylidene-6-phosphanylcyclohexylidene]methyl]methanimine is C=N/C=C1C(=C/C)\CCCC\1P.
What is the InChIKey of N-[(E)-[(2Z)-2-ethylidene-6-phosphanylcyclohexylidene]methyl]methanimine?
The InChIKey is SZWKIAZGTIWPFG-HESJCCPHSA-N. The full InChI is InChI=1S/C10H16NP/c1-3-8-5-4-6-10(12)9(8)7-11-2/h3,7,10H,2,4-6,12H2,1H3/b8-3-,9-7+.
What are the key properties of N-[(E)-[(2Z)-2-ethylidene-6-phosphanylcyclohexylidene]methyl]methanimine?
N-[(E)-[(2Z)-2-ethylidene-6-phosphanylcyclohexylidene]methyl]methanimine has a molecular weight of 181.22 g/mol, XLogP of 2.94, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-[(2Z)-2-ethylidene-6-phosphanylcyclohexylidene]methyl]methanimine is sourced from PubChem (CID 143214136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).