1-cyclopropyl-N-prop-1-en-2-ylprop-2-en-1-imine;ethane

C11H19N — CID 177243734

IUPAC1-cyclopropyl-N-prop-1-en-2-ylprop-2-en-1-imine;ethane
SMILESC=C/C(=N\C(=C)C)C1CC1.CC
InChIInChI=1S/C9H13N.C2H6/c1-4-9(8-5-6-8)10-7(2)3;1-2/h4,8H,1-2,5-6H2,3H3;1-2H3/b10-9+;
InChIKeyZIESYNVTNPDCSR-RRABGKBLSA-N
MW165.28 g/mol
LogP3.58
Rot. Bonds3

About 1-cyclopropyl-N-prop-1-en-2-ylprop-2-en-1-imine;ethane

1-cyclopropyl-N-prop-1-en-2-ylprop-2-en-1-imine;ethane (PubChem CID 177243734) has the molecular formula C11H19N and a molecular weight of 165.28 g/mol. Its IUPAC name is 1-cyclopropyl-N-prop-1-en-2-ylprop-2-en-1-imine;ethane.

Molecular Properties

Compound Name1-cyclopropyl-N-prop-1-en-2-ylprop-2-en-1-imine;ethane
PubChem CID177243734
Molecular FormulaC11H19N
Molecular Weight165.28 g/mol
Exact Mass165.15
IUPAC Name1-cyclopropyl-N-prop-1-en-2-ylprop-2-en-1-imine;ethane
SMILESC=C/C(=N\C(=C)C)C1CC1.CC
InChIInChI=1S/C9H13N.C2H6/c1-4-9(8-5-6-8)10-7(2)3;1-2/h4,8H,1-2,5-6H2,3H3;1-2H3/b10-9+;
InChIKeyZIESYNVTNPDCSR-RRABGKBLSA-N
XLogP3.58
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.28
LogP ≤ 53.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(Z)-2-methyl-N-[(E)-pent-2-en-2-yl]hex-4-en-3-imine
CID 121480618
(Z)-2-methyl-N-(3-methylbut-1-en-2-yl)hex-4-en-3-imine
CID 130348007
4-methyl-N-prop-1-en-2-ylpent-1-en-3-imine
CID 142378554
propane;N-prop-1-en-2-ylhept-1-en-3-imine
CID 143101176
N-[(Z)-but-2-en-2-yl]hex-1-en-3-imine
CID 143926350
1-cyclopropyl-N-prop-1-en-2-ylprop-2-en-1-imine
CID 144912503
5-methyl-N-prop-1-en-2-ylhex-1-en-3-imine
CID 145061781
N-[(Z)-but-2-en-2-yl]-2,4-dimethylpent-1-en-3-imine
CID 146182511
N-[(E)-2-(2-methylcyclopropyl)ethenyl]hex-1-en-3-imine
CID 155052675
(Z)-N-[(Z)-but-2-en-2-yl]-7-methyl-3-methylidenenon-5-en-4-imine
CID 155402604
(E)-1-cyclopropyl-3-methyl-N-prop-1-en-2-ylpent-2-en-1-imine
CID 166976426
(2E,5E)-1-cyclopropyl-3-methyl-N-prop-1-en-2-ylhepta-2,5-dien-1-imine
CID 166976486

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-prop-1-en-2-ylprop-2-en-1-imine;ethane?
The IUPAC name of 1-cyclopropyl-N-prop-1-en-2-ylprop-2-en-1-imine;ethane (CID 177243734) is 1-cyclopropyl-N-prop-1-en-2-ylprop-2-en-1-imine;ethane.
What is the SMILES notation for 1-cyclopropyl-N-prop-1-en-2-ylprop-2-en-1-imine;ethane?
The canonical SMILES for 1-cyclopropyl-N-prop-1-en-2-ylprop-2-en-1-imine;ethane is C=C/C(=N\C(=C)C)C1CC1.CC.
What is the InChIKey of 1-cyclopropyl-N-prop-1-en-2-ylprop-2-en-1-imine;ethane?
The InChIKey is ZIESYNVTNPDCSR-RRABGKBLSA-N. The full InChI is InChI=1S/C9H13N.C2H6/c1-4-9(8-5-6-8)10-7(2)3;1-2/h4,8H,1-2,5-6H2,3H3;1-2H3/b10-9+;.
What are the key properties of 1-cyclopropyl-N-prop-1-en-2-ylprop-2-en-1-imine;ethane?
1-cyclopropyl-N-prop-1-en-2-ylprop-2-en-1-imine;ethane has a molecular weight of 165.28 g/mol, XLogP of 3.58, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-prop-1-en-2-ylprop-2-en-1-imine;ethane is sourced from PubChem (CID 177243734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).