N'-[(Z)-2-methylpent-1-enyl]ethanimidamide

C8H16N2 — CID 89168232

IUPACN'-[(Z)-2-methylpent-1-enyl]ethanimidamide
SMILESCCC/C(C)=C\N=C(/C)N
InChIInChI=1S/C8H16N2/c1-4-5-7(2)6-10-8(3)9/h6H,4-5H2,1-3H3,(H2,9,10)/b7-6-
InChIKeyNOXIDZFVDWXWAE-SREVYHEPSA-N
MW140.23 g/mol
LogP2.07
Rot. Bonds3

About N'-[(Z)-2-methylpent-1-enyl]ethanimidamide

N'-[(Z)-2-methylpent-1-enyl]ethanimidamide (PubChem CID 89168232) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is N'-[(Z)-2-methylpent-1-enyl]ethanimidamide.

Molecular Properties

Compound NameN'-[(Z)-2-methylpent-1-enyl]ethanimidamide
PubChem CID89168232
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC NameN'-[(Z)-2-methylpent-1-enyl]ethanimidamide
SMILESCCC/C(C)=C\N=C(/C)N
InChIInChI=1S/C8H16N2/c1-4-5-7(2)6-10-8(3)9/h6H,4-5H2,1-3H3,(H2,9,10)/b7-6-
InChIKeyNOXIDZFVDWXWAE-SREVYHEPSA-N
XLogP2.07
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 52.07
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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Frequently Asked Questions

What is the IUPAC name of N'-[(Z)-2-methylpent-1-enyl]ethanimidamide?
The IUPAC name of N'-[(Z)-2-methylpent-1-enyl]ethanimidamide (CID 89168232) is N'-[(Z)-2-methylpent-1-enyl]ethanimidamide.
What is the SMILES notation for N'-[(Z)-2-methylpent-1-enyl]ethanimidamide?
The canonical SMILES for N'-[(Z)-2-methylpent-1-enyl]ethanimidamide is CCC/C(C)=C\N=C(/C)N.
What is the InChIKey of N'-[(Z)-2-methylpent-1-enyl]ethanimidamide?
The InChIKey is NOXIDZFVDWXWAE-SREVYHEPSA-N. The full InChI is InChI=1S/C8H16N2/c1-4-5-7(2)6-10-8(3)9/h6H,4-5H2,1-3H3,(H2,9,10)/b7-6-.
What are the key properties of N'-[(Z)-2-methylpent-1-enyl]ethanimidamide?
N'-[(Z)-2-methylpent-1-enyl]ethanimidamide has a molecular weight of 140.23 g/mol, XLogP of 2.07, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[(Z)-2-methylpent-1-enyl]ethanimidamide is sourced from PubChem (CID 89168232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).