(Z)-pent-3-en-2-imine

C5H9N — CID 90707502

IUPAC(Z)-pent-3-en-2-imine
SMILES[H]/N=C(C)/C=C\C
InChIInChI=1S/C5H9N/c1-3-4-5(2)6/h3-4,6H,1-2H3/b4-3-,6-5+
InChIKeyXHNNGOGLLILASH-DNVGVPOPSA-N
MW83.13 g/mol
LogP1.60
Rot. Bonds1

About (Z)-pent-3-en-2-imine

(Z)-pent-3-en-2-imine (PubChem CID 90707502) has the molecular formula C5H9N and a molecular weight of 83.13 g/mol. Its IUPAC name is (Z)-pent-3-en-2-imine.

Molecular Properties

Compound Name(Z)-pent-3-en-2-imine
PubChem CID90707502
Molecular FormulaC5H9N
Molecular Weight83.13 g/mol
Exact Mass83.07
IUPAC Name(Z)-pent-3-en-2-imine
SMILES[H]/N=C(C)/C=C\C
InChIInChI=1S/C5H9N/c1-3-4-5(2)6/h3-4,6H,1-2H3/b4-3-,6-5+
InChIKeyXHNNGOGLLILASH-DNVGVPOPSA-N
XLogP1.60
TPSA23.85 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50083.13
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

Cyclopenta-2,4-dien-1-imine
CID 53849321
(E)-1,5-difluoropent-3-en-2-imine
CID 134933350
2,5-Cyclohexadien-1-imine
CID 6336073
1-Methyl-4-imino-2,5-cyclohexadiene
CID 12984282
2,6-Dimethylhepta-2,5-dien-4-imine
CID 23064947
2,4,6-Cycloheptatriene-1-imine
CID 54111625
(4E)-4-fluorohepta-1,4-dien-3-imine
CID 91304230
(E)-5-fluorohex-4-en-3-imine
CID 91325186
(3Z)-5-fluorohexa-3,5-dien-2-imine
CID 91396866
(E)-3-fluorohex-3-en-2-imine
CID 123164683
4-Fluorocyclohepta-2,6-dien-1-imine
CID 123197524
(E)-4-fluoro-5-methylhex-3-en-2-imine
CID 123219991

Frequently Asked Questions

What is the IUPAC name of (Z)-pent-3-en-2-imine?
The IUPAC name of (Z)-pent-3-en-2-imine (CID 90707502) is (Z)-pent-3-en-2-imine.
What is the SMILES notation for (Z)-pent-3-en-2-imine?
The canonical SMILES for (Z)-pent-3-en-2-imine is [H]/N=C(C)/C=C\C.
What is the InChIKey of (Z)-pent-3-en-2-imine?
The InChIKey is XHNNGOGLLILASH-DNVGVPOPSA-N. The full InChI is InChI=1S/C5H9N/c1-3-4-5(2)6/h3-4,6H,1-2H3/b4-3-,6-5+.
What are the key properties of (Z)-pent-3-en-2-imine?
(Z)-pent-3-en-2-imine has a molecular weight of 83.13 g/mol, XLogP of 1.60, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-pent-3-en-2-imine is sourced from PubChem (CID 90707502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).