ethane;N'-ethenyl-N-methylideneethanimidamide

C11H26N2 — CID 142057668

IUPACethane;N'-ethenyl-N-methylideneethanimidamide
SMILESC=C/N=C(\C)N=C.CC.CC.CC
InChIInChI=1S/C5H8N2.3C2H6/c1-4-7-5(2)6-3;3*1-2/h4H,1,3H2,2H3;3*1-2H3/b7-5+;;;
InChIKeySXENBUOLKWOLFW-OACAQMFHSA-N
MW186.34 g/mol
LogP4.33
Rot. Bonds1

About ethane;N'-ethenyl-N-methylideneethanimidamide

ethane;N'-ethenyl-N-methylideneethanimidamide (PubChem CID 142057668) has the molecular formula C11H26N2 and a molecular weight of 186.34 g/mol. Its IUPAC name is ethane;N'-ethenyl-N-methylideneethanimidamide.

Molecular Properties

Compound Nameethane;N'-ethenyl-N-methylideneethanimidamide
PubChem CID142057668
Molecular FormulaC11H26N2
Molecular Weight186.34 g/mol
Exact Mass186.21
IUPAC Nameethane;N'-ethenyl-N-methylideneethanimidamide
SMILESC=C/N=C(\C)N=C.CC.CC.CC
InChIInChI=1S/C5H8N2.3C2H6/c1-4-7-5(2)6-3;3*1-2/h4H,1,3H2,2H3;3*1-2H3/b7-5+;;;
InChIKeySXENBUOLKWOLFW-OACAQMFHSA-N
XLogP4.33
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.34
LogP ≤ 54.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

ethane;N'-ethenyl-N-ethylidene-2,2,2-trifluoroethanimidamide
CID 143343721
N'-(ethenyliminomethyl)ethanimidamide
CID 88888742
N'-ethenyl-N-ethylidene-2,2-dimethylpropanimidamide
CID 88949136
N'-[(Z)-2-(methylideneamino)ethenyl]ethanimidamide
CID 89029563
N'-ethenyl-N-ethylideneethanimidamide
CID 117650339
N'-ethenyl-N-[(ethylideneamino)methylidene]methanimidamide
CID 129288737
N,N-bis(ethenyl)-N'-methyl-2-methyliminoethanimidamide
CID 130247457
N'-methyl-N-[2-(methylideneamino)ethenylidene]ethanimidamide
CID 132136577
N'-(ethenyliminomethyl)-2-methyl-N-methylidenepropanimidamide
CID 134244000
N'-ethenyl-N-ethenyliminoethanimidamide
CID 137491664
N'-ethenyl-N-methylidenepropanimidamide
CID 139386695
ethane;N-ethylidene-N'-[(Z)-prop-1-enyl]ethanimidamide
CID 141827139

Frequently Asked Questions

What is the IUPAC name of ethane;N'-ethenyl-N-methylideneethanimidamide?
The IUPAC name of ethane;N'-ethenyl-N-methylideneethanimidamide (CID 142057668) is ethane;N'-ethenyl-N-methylideneethanimidamide.
What is the SMILES notation for ethane;N'-ethenyl-N-methylideneethanimidamide?
The canonical SMILES for ethane;N'-ethenyl-N-methylideneethanimidamide is C=C/N=C(\C)N=C.CC.CC.CC.
What is the InChIKey of ethane;N'-ethenyl-N-methylideneethanimidamide?
The InChIKey is SXENBUOLKWOLFW-OACAQMFHSA-N. The full InChI is InChI=1S/C5H8N2.3C2H6/c1-4-7-5(2)6-3;3*1-2/h4H,1,3H2,2H3;3*1-2H3/b7-5+;;;.
What are the key properties of ethane;N'-ethenyl-N-methylideneethanimidamide?
ethane;N'-ethenyl-N-methylideneethanimidamide has a molecular weight of 186.34 g/mol, XLogP of 4.33, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N'-ethenyl-N-methylideneethanimidamide is sourced from PubChem (CID 142057668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).