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

C9H13N — CID 144912503

IUPAC1-cyclopropyl-N-prop-1-en-2-ylprop-2-en-1-imine
SMILESC=C/C(=N\C(=C)C)C1CC1
InChIInChI=1S/C9H13N/c1-4-9(8-5-6-8)10-7(2)3/h4,8H,1-2,5-6H2,3H3/b10-9+
InChIKeyKHWUTBCZWWEOIE-MDZDMXLPSA-N
MW135.21 g/mol
LogP2.56
Rot. Bonds3

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

1-cyclopropyl-N-prop-1-en-2-ylprop-2-en-1-imine (PubChem CID 144912503) has the molecular formula C9H13N and a molecular weight of 135.21 g/mol. Its IUPAC name is 1-cyclopropyl-N-prop-1-en-2-ylprop-2-en-1-imine.

Molecular Properties

Compound Name1-cyclopropyl-N-prop-1-en-2-ylprop-2-en-1-imine
PubChem CID144912503
Molecular FormulaC9H13N
Molecular Weight135.21 g/mol
Exact Mass135.10
IUPAC Name1-cyclopropyl-N-prop-1-en-2-ylprop-2-en-1-imine
SMILESC=C/C(=N\C(=C)C)C1CC1
InChIInChI=1S/C9H13N/c1-4-9(8-5-6-8)10-7(2)3/h4,8H,1-2,5-6H2,3H3/b10-9+
InChIKeyKHWUTBCZWWEOIE-MDZDMXLPSA-N
XLogP2.56
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.21
LogP ≤ 52.56
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

1-cyclopropyl-N-methylprop-2-en-1-imine
CID 130440573
N-prop-1-en-2-ylpent-1-en-3-imine
CID 142229337
4-methyl-N-prop-1-en-2-ylpent-1-en-3-imine
CID 142378554
5-methyl-N-prop-1-en-2-ylhex-1-en-3-imine
CID 145061781
N-(3-methylbut-1-en-2-yl)but-3-en-2-imine
CID 153572346
N-[(E)-2-(2-methylcyclopropyl)ethenyl]hex-1-en-3-imine
CID 155052675
(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
N-(1-cyclopropylethenyl)-3-methylbut-3-en-2-imine
CID 177243627
1-cyclopropyl-N-prop-1-en-2-ylprop-2-en-1-imine;ethane
CID 177243734
N-[(Z)-but-2-en-2-yl]-1-cyclopropylethanimine
CID 144514110
1-cyclopropyl-N-methylbuta-2,3-dien-1-imine
CID 166084214

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-prop-1-en-2-ylprop-2-en-1-imine?
The IUPAC name of 1-cyclopropyl-N-prop-1-en-2-ylprop-2-en-1-imine (CID 144912503) is 1-cyclopropyl-N-prop-1-en-2-ylprop-2-en-1-imine.
What is the SMILES notation for 1-cyclopropyl-N-prop-1-en-2-ylprop-2-en-1-imine?
The canonical SMILES for 1-cyclopropyl-N-prop-1-en-2-ylprop-2-en-1-imine is C=C/C(=N\C(=C)C)C1CC1.
What is the InChIKey of 1-cyclopropyl-N-prop-1-en-2-ylprop-2-en-1-imine?
The InChIKey is KHWUTBCZWWEOIE-MDZDMXLPSA-N. The full InChI is InChI=1S/C9H13N/c1-4-9(8-5-6-8)10-7(2)3/h4,8H,1-2,5-6H2,3H3/b10-9+.
What are the key properties of 1-cyclopropyl-N-prop-1-en-2-ylprop-2-en-1-imine?
1-cyclopropyl-N-prop-1-en-2-ylprop-2-en-1-imine has a molecular weight of 135.21 g/mol, XLogP of 2.56, 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 is sourced from PubChem (CID 144912503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).