N-[(Z)-but-2-en-2-yl]hex-1-en-3-imine

C10H17N — CID 143926350

IUPACN-[(Z)-but-2-en-2-yl]hex-1-en-3-imine
SMILESC=C/C(CCC)=N\C(C)=C/C
InChIInChI=1S/C10H17N/c1-5-8-10(7-3)11-9(4)6-2/h6-7H,3,5,8H2,1-2,4H3/b9-6-,11-10+
InChIKeyVTZICOYXIGFIAW-KBCDKWTQSA-N
MW151.25 g/mol
LogP3.34
Rot. Bonds4

About N-[(Z)-but-2-en-2-yl]hex-1-en-3-imine

N-[(Z)-but-2-en-2-yl]hex-1-en-3-imine (PubChem CID 143926350) has the molecular formula C10H17N and a molecular weight of 151.25 g/mol. Its IUPAC name is N-[(Z)-but-2-en-2-yl]hex-1-en-3-imine.

Molecular Properties

Compound NameN-[(Z)-but-2-en-2-yl]hex-1-en-3-imine
PubChem CID143926350
Molecular FormulaC10H17N
Molecular Weight151.25 g/mol
Exact Mass151.14
IUPAC NameN-[(Z)-but-2-en-2-yl]hex-1-en-3-imine
SMILESC=C/C(CCC)=N\C(C)=C/C
InChIInChI=1S/C10H17N/c1-5-8-10(7-3)11-9(4)6-2/h6-7H,3,5,8H2,1-2,4H3/b9-6-,11-10+
InChIKeyVTZICOYXIGFIAW-KBCDKWTQSA-N
XLogP3.34
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.25
LogP ≤ 53.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[(Z)-but-2-en-2-yl]hex-1-en-3-imine?
The IUPAC name of N-[(Z)-but-2-en-2-yl]hex-1-en-3-imine (CID 143926350) is N-[(Z)-but-2-en-2-yl]hex-1-en-3-imine.
What is the SMILES notation for N-[(Z)-but-2-en-2-yl]hex-1-en-3-imine?
The canonical SMILES for N-[(Z)-but-2-en-2-yl]hex-1-en-3-imine is C=C/C(CCC)=N\C(C)=C/C.
What is the InChIKey of N-[(Z)-but-2-en-2-yl]hex-1-en-3-imine?
The InChIKey is VTZICOYXIGFIAW-KBCDKWTQSA-N. The full InChI is InChI=1S/C10H17N/c1-5-8-10(7-3)11-9(4)6-2/h6-7H,3,5,8H2,1-2,4H3/b9-6-,11-10+.
What are the key properties of N-[(Z)-but-2-en-2-yl]hex-1-en-3-imine?
N-[(Z)-but-2-en-2-yl]hex-1-en-3-imine has a molecular weight of 151.25 g/mol, XLogP of 3.34, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-but-2-en-2-yl]hex-1-en-3-imine is sourced from PubChem (CID 143926350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).