(Z)-1-cyclopropyl-N,3-dimethylhex-2-en-1-imine

C11H19N — CID 176925654

IUPAC(Z)-1-cyclopropyl-N,3-dimethylhex-2-en-1-imine
SMILESCCC/C(C)=C\C(=N\C)C1CC1
InChIInChI=1S/C11H19N/c1-4-5-9(2)8-11(12-3)10-6-7-10/h8,10H,4-7H2,1-3H3/b9-8-,12-11-
InChIKeyGLKJRCHZMXDPHU-MURFETPASA-N
MW165.28 g/mol
LogP3.21
Rot. Bonds4

About (Z)-1-cyclopropyl-N,3-dimethylhex-2-en-1-imine

(Z)-1-cyclopropyl-N,3-dimethylhex-2-en-1-imine (PubChem CID 176925654) has the molecular formula C11H19N and a molecular weight of 165.28 g/mol. Its IUPAC name is (Z)-1-cyclopropyl-N,3-dimethylhex-2-en-1-imine.

Molecular Properties

Compound Name(Z)-1-cyclopropyl-N,3-dimethylhex-2-en-1-imine
PubChem CID176925654
Molecular FormulaC11H19N
Molecular Weight165.28 g/mol
Exact Mass165.15
IUPAC Name(Z)-1-cyclopropyl-N,3-dimethylhex-2-en-1-imine
SMILESCCC/C(C)=C\C(=N\C)C1CC1
InChIInChI=1S/C11H19N/c1-4-5-9(2)8-11(12-3)10-6-7-10/h8,10H,4-7H2,1-3H3/b9-8-,12-11-
InChIKeyGLKJRCHZMXDPHU-MURFETPASA-N
XLogP3.21
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.28
LogP ≤ 53.21
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 (Z)-1-cyclopropyl-N,3-dimethylhex-2-en-1-imine?
The IUPAC name of (Z)-1-cyclopropyl-N,3-dimethylhex-2-en-1-imine (CID 176925654) is (Z)-1-cyclopropyl-N,3-dimethylhex-2-en-1-imine.
What is the SMILES notation for (Z)-1-cyclopropyl-N,3-dimethylhex-2-en-1-imine?
The canonical SMILES for (Z)-1-cyclopropyl-N,3-dimethylhex-2-en-1-imine is CCC/C(C)=C\C(=N\C)C1CC1.
What is the InChIKey of (Z)-1-cyclopropyl-N,3-dimethylhex-2-en-1-imine?
The InChIKey is GLKJRCHZMXDPHU-MURFETPASA-N. The full InChI is InChI=1S/C11H19N/c1-4-5-9(2)8-11(12-3)10-6-7-10/h8,10H,4-7H2,1-3H3/b9-8-,12-11-.
What are the key properties of (Z)-1-cyclopropyl-N,3-dimethylhex-2-en-1-imine?
(Z)-1-cyclopropyl-N,3-dimethylhex-2-en-1-imine has a molecular weight of 165.28 g/mol, XLogP of 3.21, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-cyclopropyl-N,3-dimethylhex-2-en-1-imine is sourced from PubChem (CID 176925654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).