N'-[(Z)-4-methylhex-2-enyl]-N-prop-1-en-2-ylmethanimidamide

C11H20N2 — CID 155371478

IUPACN'-[(Z)-4-methylhex-2-enyl]-N-prop-1-en-2-ylmethanimidamide
SMILESC=C(C)N/C=N/C/C=C\C(C)CC
InChIInChI=1S/C11H20N2/c1-5-11(4)7-6-8-12-9-13-10(2)3/h6-7,9,11H,2,5,8H2,1,3-4H3,(H,12,13)/b7-6-
InChIKeyJVWXEPREGJIXDP-SREVYHEPSA-N
MW180.29 g/mol
LogP2.74
Rot. Bonds6

About N'-[(Z)-4-methylhex-2-enyl]-N-prop-1-en-2-ylmethanimidamide

N'-[(Z)-4-methylhex-2-enyl]-N-prop-1-en-2-ylmethanimidamide (PubChem CID 155371478) has the molecular formula C11H20N2 and a molecular weight of 180.29 g/mol. Its IUPAC name is N'-[(Z)-4-methylhex-2-enyl]-N-prop-1-en-2-ylmethanimidamide.

Molecular Properties

Compound NameN'-[(Z)-4-methylhex-2-enyl]-N-prop-1-en-2-ylmethanimidamide
PubChem CID155371478
Molecular FormulaC11H20N2
Molecular Weight180.29 g/mol
Exact Mass180.16
IUPAC NameN'-[(Z)-4-methylhex-2-enyl]-N-prop-1-en-2-ylmethanimidamide
SMILESC=C(C)N/C=N/C/C=C\C(C)CC
InChIInChI=1S/C11H20N2/c1-5-11(4)7-6-8-12-9-13-10(2)3/h6-7,9,11H,2,5,8H2,1,3-4H3,(H,12,13)/b7-6-
InChIKeyJVWXEPREGJIXDP-SREVYHEPSA-N
XLogP2.74
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.29
LogP ≤ 52.74
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'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N'-[(Z)-4-methylhex-2-enyl]-N-prop-1-en-2-ylmethanimidamide?
The IUPAC name of N'-[(Z)-4-methylhex-2-enyl]-N-prop-1-en-2-ylmethanimidamide (CID 155371478) is N'-[(Z)-4-methylhex-2-enyl]-N-prop-1-en-2-ylmethanimidamide.
What is the SMILES notation for N'-[(Z)-4-methylhex-2-enyl]-N-prop-1-en-2-ylmethanimidamide?
The canonical SMILES for N'-[(Z)-4-methylhex-2-enyl]-N-prop-1-en-2-ylmethanimidamide is C=C(C)N/C=N/C/C=C\C(C)CC.
What is the InChIKey of N'-[(Z)-4-methylhex-2-enyl]-N-prop-1-en-2-ylmethanimidamide?
The InChIKey is JVWXEPREGJIXDP-SREVYHEPSA-N. The full InChI is InChI=1S/C11H20N2/c1-5-11(4)7-6-8-12-9-13-10(2)3/h6-7,9,11H,2,5,8H2,1,3-4H3,(H,12,13)/b7-6-.
What are the key properties of N'-[(Z)-4-methylhex-2-enyl]-N-prop-1-en-2-ylmethanimidamide?
N'-[(Z)-4-methylhex-2-enyl]-N-prop-1-en-2-ylmethanimidamide has a molecular weight of 180.29 g/mol, XLogP of 2.74, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[(Z)-4-methylhex-2-enyl]-N-prop-1-en-2-ylmethanimidamide is sourced from PubChem (CID 155371478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).