4-[(Z)-2-methylbut-1-enyl]iminopent-1-en-2-amine

C10H18N2 — CID 89224443

IUPAC4-[(Z)-2-methylbut-1-enyl]iminopent-1-en-2-amine
SMILESC=C(N)C/C(C)=N/C=C(/C)CC
InChIInChI=1S/C10H18N2/c1-5-8(2)7-12-10(4)6-9(3)11/h7H,3,5-6,11H2,1-2,4H3/b8-7-,12-10+
InChIKeyIGIYBPGLPXGUQG-QOUMFGDESA-N
MW166.27 g/mol
LogP2.62
Rot. Bonds4

About 4-[(Z)-2-methylbut-1-enyl]iminopent-1-en-2-amine

4-[(Z)-2-methylbut-1-enyl]iminopent-1-en-2-amine (PubChem CID 89224443) has the molecular formula C10H18N2 and a molecular weight of 166.27 g/mol. Its IUPAC name is 4-[(Z)-2-methylbut-1-enyl]iminopent-1-en-2-amine.

Molecular Properties

Compound Name4-[(Z)-2-methylbut-1-enyl]iminopent-1-en-2-amine
PubChem CID89224443
Molecular FormulaC10H18N2
Molecular Weight166.27 g/mol
Exact Mass166.15
IUPAC Name4-[(Z)-2-methylbut-1-enyl]iminopent-1-en-2-amine
SMILESC=C(N)C/C(C)=N/C=C(/C)CC
InChIInChI=1S/C10H18N2/c1-5-8(2)7-12-10(4)6-9(3)11/h7H,3,5-6,11H2,1-2,4H3/b8-7-,12-10+
InChIKeyIGIYBPGLPXGUQG-QOUMFGDESA-N
XLogP2.62
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.27
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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 4-[(Z)-2-methylbut-1-enyl]iminopent-1-en-2-amine?
The IUPAC name of 4-[(Z)-2-methylbut-1-enyl]iminopent-1-en-2-amine (CID 89224443) is 4-[(Z)-2-methylbut-1-enyl]iminopent-1-en-2-amine.
What is the SMILES notation for 4-[(Z)-2-methylbut-1-enyl]iminopent-1-en-2-amine?
The canonical SMILES for 4-[(Z)-2-methylbut-1-enyl]iminopent-1-en-2-amine is C=C(N)C/C(C)=N/C=C(/C)CC.
What is the InChIKey of 4-[(Z)-2-methylbut-1-enyl]iminopent-1-en-2-amine?
The InChIKey is IGIYBPGLPXGUQG-QOUMFGDESA-N. The full InChI is InChI=1S/C10H18N2/c1-5-8(2)7-12-10(4)6-9(3)11/h7H,3,5-6,11H2,1-2,4H3/b8-7-,12-10+.
What are the key properties of 4-[(Z)-2-methylbut-1-enyl]iminopent-1-en-2-amine?
4-[(Z)-2-methylbut-1-enyl]iminopent-1-en-2-amine has a molecular weight of 166.27 g/mol, XLogP of 2.62, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(Z)-2-methylbut-1-enyl]iminopent-1-en-2-amine is sourced from PubChem (CID 89224443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).