N'-[(E)-3,4-dimethylpent-2-en-2-yl]-N-methylideneethanimidamide

C10H18N2 — CID 154973119

IUPACN'-[(E)-3,4-dimethylpent-2-en-2-yl]-N-methylideneethanimidamide
SMILESC=N/C(C)=N/C(C)=C(\C)C(C)C
InChIInChI=1S/C10H18N2/c1-7(2)8(3)9(4)12-10(5)11-6/h7H,6H2,1-5H3/b9-8+,12-10+
InChIKeySXMLSUXUOQXPJM-CDKJVOIVSA-N
MW166.27 g/mol
LogP3.06
Rot. Bonds2

About N'-[(E)-3,4-dimethylpent-2-en-2-yl]-N-methylideneethanimidamide

N'-[(E)-3,4-dimethylpent-2-en-2-yl]-N-methylideneethanimidamide (PubChem CID 154973119) has the molecular formula C10H18N2 and a molecular weight of 166.27 g/mol. Its IUPAC name is N'-[(E)-3,4-dimethylpent-2-en-2-yl]-N-methylideneethanimidamide.

Molecular Properties

Compound NameN'-[(E)-3,4-dimethylpent-2-en-2-yl]-N-methylideneethanimidamide
PubChem CID154973119
Molecular FormulaC10H18N2
Molecular Weight166.27 g/mol
Exact Mass166.15
IUPAC NameN'-[(E)-3,4-dimethylpent-2-en-2-yl]-N-methylideneethanimidamide
SMILESC=N/C(C)=N/C(C)=C(\C)C(C)C
InChIInChI=1S/C10H18N2/c1-7(2)8(3)9(4)12-10(5)11-6/h7H,6H2,1-5H3/b9-8+,12-10+
InChIKeySXMLSUXUOQXPJM-CDKJVOIVSA-N
XLogP3.06
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.27
LogP ≤ 53.06
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

N'-(C,N-dimethylcarbonimidoyl)-2-methyl-N-methylidenepropanimidamide
CID 155041471
methane;(Z)-2,3,4,5-tetramethylhex-3-ene;(E)-2,3,4,5-tetramethylhex-3-ene
CID 161097810
N-methylidene-N'-(3-oxobut-1-en-2-yl)ethanimidamide
CID 176965956
N-[(Z)-4-methyl-3-methylsulfanylpent-2-en-2-yl]methanimine
CID 126704572
2,3,4-trimethylpent-2-ene
CID 11270
2,3,4,5,6,7,8,9,10,11-decamethyldodeca-3,6,9-triene
CID 123882095
(3E)-2,4,5-trimethylhexa-1,3-dien-3-ol
CID 144743244
(E)-2-fluoro-N,3,4-trimethylpent-2-en-1-imine
CID 163527626
(Z)-3,4-dimethylpent-2-ene-2-thiol
CID 176996545
2,3-difluoro-5-methyl-4-methylidenehex-2-ene
CID 123737950
N'-(dimethylamino)-N-methylideneethanimidamide;ethane
CID 143697937
N-[(Z)-3-methyl-2-(methylideneamino)but-1-enyl]propan-2-imine
CID 167248501

Frequently Asked Questions

What is the IUPAC name of N'-[(E)-3,4-dimethylpent-2-en-2-yl]-N-methylideneethanimidamide?
The IUPAC name of N'-[(E)-3,4-dimethylpent-2-en-2-yl]-N-methylideneethanimidamide (CID 154973119) is N'-[(E)-3,4-dimethylpent-2-en-2-yl]-N-methylideneethanimidamide.
What is the SMILES notation for N'-[(E)-3,4-dimethylpent-2-en-2-yl]-N-methylideneethanimidamide?
The canonical SMILES for N'-[(E)-3,4-dimethylpent-2-en-2-yl]-N-methylideneethanimidamide is C=N/C(C)=N/C(C)=C(\C)C(C)C.
What is the InChIKey of N'-[(E)-3,4-dimethylpent-2-en-2-yl]-N-methylideneethanimidamide?
The InChIKey is SXMLSUXUOQXPJM-CDKJVOIVSA-N. The full InChI is InChI=1S/C10H18N2/c1-7(2)8(3)9(4)12-10(5)11-6/h7H,6H2,1-5H3/b9-8+,12-10+.
What are the key properties of N'-[(E)-3,4-dimethylpent-2-en-2-yl]-N-methylideneethanimidamide?
N'-[(E)-3,4-dimethylpent-2-en-2-yl]-N-methylideneethanimidamide has a molecular weight of 166.27 g/mol, XLogP of 3.06, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[(E)-3,4-dimethylpent-2-en-2-yl]-N-methylideneethanimidamide is sourced from PubChem (CID 154973119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).