N'-ethenyl-4-methylpentanimidamide

C8H16N2 — CID 145116247

IUPACN'-ethenyl-4-methylpentanimidamide
SMILESC=C/N=C(/N)CCC(C)C
InChIInChI=1S/C8H16N2/c1-4-10-8(9)6-5-7(2)3/h4,7H,1,5-6H2,2-3H3,(H2,9,10)
InChIKeyJMVXDUZVLJYCQY-UHFFFAOYSA-N
MW140.23 g/mol
LogP1.92
Rot. Bonds4

About N'-ethenyl-4-methylpentanimidamide

N'-ethenyl-4-methylpentanimidamide (PubChem CID 145116247) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is N'-ethenyl-4-methylpentanimidamide.

Molecular Properties

Compound NameN'-ethenyl-4-methylpentanimidamide
PubChem CID145116247
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC NameN'-ethenyl-4-methylpentanimidamide
SMILESC=C/N=C(/N)CCC(C)C
InChIInChI=1S/C8H16N2/c1-4-10-8(9)6-5-7(2)3/h4,7H,1,5-6H2,2-3H3,(H2,9,10)
InChIKeyJMVXDUZVLJYCQY-UHFFFAOYSA-N
XLogP1.92
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 51.92
H-Bond Donors ≤ 51
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

(3Z)-N'-ethenyl-2-methyl-3-(propan-2-ylidenehydrazinylidene)butanimidamide
CID 90934415
N'-ethenyl-3-methylbutanimidamide
CID 90960245
N'-[(Z)-2-(methylamino)ethenyl]cyclobutanecarboximidamide
CID 117828133
N'-ethenyl-2,3-dimethylbutanimidamide
CID 139321180
2-cyclobutyl-N'-ethenylethanimidamide
CID 146321464
3-methyl-N'-[(Z)-prop-1-enyl]butanimidamide
CID 146476313
(2R)-N'-ethyl-2-methylpentanimidamide
CID 149048954
N'-ethenyl-2-methylbutanimidamide
CID 155258668
N'-butyl-4-methylpentanimidamide
CID 166731562
(3S,4S)-6-amino-N'-ethenyl-4-ethyl-3-methylhexanimidamide
CID 174089878
(3S)-N'-ethenyl-4-ethyl-3-methyl-6-(methylamino)hexanimidamide
CID 174089882
N'-(4-methylpentyl)propanimidamide
CID 63181200

Frequently Asked Questions

What is the IUPAC name of N'-ethenyl-4-methylpentanimidamide?
The IUPAC name of N'-ethenyl-4-methylpentanimidamide (CID 145116247) is N'-ethenyl-4-methylpentanimidamide.
What is the SMILES notation for N'-ethenyl-4-methylpentanimidamide?
The canonical SMILES for N'-ethenyl-4-methylpentanimidamide is C=C/N=C(/N)CCC(C)C.
What is the InChIKey of N'-ethenyl-4-methylpentanimidamide?
The InChIKey is JMVXDUZVLJYCQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2/c1-4-10-8(9)6-5-7(2)3/h4,7H,1,5-6H2,2-3H3,(H2,9,10).
What are the key properties of N'-ethenyl-4-methylpentanimidamide?
N'-ethenyl-4-methylpentanimidamide has a molecular weight of 140.23 g/mol, XLogP of 1.92, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-ethenyl-4-methylpentanimidamide is sourced from PubChem (CID 145116247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).