(Z)-3-[(E)-pent-1-enyl]iminoprop-1-en-1-amine

C8H14N2 — CID 163673678

IUPAC(Z)-3-[(E)-pent-1-enyl]iminoprop-1-en-1-amine
SMILESCCC/C=C/N=C/C=C\N
InChIInChI=1S/C8H14N2/c1-2-3-4-7-10-8-5-6-9/h4-8H,2-3,9H2,1H3/b6-5-,7-4+,10-8+
InChIKeyJETMJZPKQKDCJB-GJYHHJNBSA-N
MW138.21 g/mol
LogP1.84
Rot. Bonds4

About (Z)-3-[(E)-pent-1-enyl]iminoprop-1-en-1-amine

(Z)-3-[(E)-pent-1-enyl]iminoprop-1-en-1-amine (PubChem CID 163673678) has the molecular formula C8H14N2 and a molecular weight of 138.21 g/mol. Its IUPAC name is (Z)-3-[(E)-pent-1-enyl]iminoprop-1-en-1-amine.

Molecular Properties

Compound Name(Z)-3-[(E)-pent-1-enyl]iminoprop-1-en-1-amine
PubChem CID163673678
Molecular FormulaC8H14N2
Molecular Weight138.21 g/mol
Exact Mass138.12
IUPAC Name(Z)-3-[(E)-pent-1-enyl]iminoprop-1-en-1-amine
SMILESCCC/C=C/N=C/C=C\N
InChIInChI=1S/C8H14N2/c1-2-3-4-7-10-8-5-6-9/h4-8H,2-3,9H2,1H3/b6-5-,7-4+,10-8+
InChIKeyJETMJZPKQKDCJB-GJYHHJNBSA-N
XLogP1.84
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.21
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-ethyl-N'-[(E)-pent-1-enyl]ethane-1,2-diimine
CID 123367431
(E)-1-nitrosopent-1-ene
CID 148875645
N-[(Z)-pent-1-enyl]propan-2-imine
CID 145467907
(4Z,8E)-dodeca-4,8-diene
CID 12576906
ethane;(E)-oct-4-ene
CID 142055407
(4E,8E)-dodeca-4,8-diene
CID 12576905
octa-2,4-dien-1-amine
CID 3847298
(Z)-N-[(1E)-penta-1,4-dienyl]pent-2-en-1-imine
CID 137383458
[(E)-hex-2-enyl]phosphane
CID 88550946
(Z)-4-(ethylideneamino)but-3-en-1-amine
CID 89468696
(E)-hex-2-en-1-ol;hydrochloride
CID 141009996
(E)-hex-2-enal
CID 158800846

Frequently Asked Questions

What is the IUPAC name of (Z)-3-[(E)-pent-1-enyl]iminoprop-1-en-1-amine?
The IUPAC name of (Z)-3-[(E)-pent-1-enyl]iminoprop-1-en-1-amine (CID 163673678) is (Z)-3-[(E)-pent-1-enyl]iminoprop-1-en-1-amine.
What is the SMILES notation for (Z)-3-[(E)-pent-1-enyl]iminoprop-1-en-1-amine?
The canonical SMILES for (Z)-3-[(E)-pent-1-enyl]iminoprop-1-en-1-amine is CCC/C=C/N=C/C=C\N.
What is the InChIKey of (Z)-3-[(E)-pent-1-enyl]iminoprop-1-en-1-amine?
The InChIKey is JETMJZPKQKDCJB-GJYHHJNBSA-N. The full InChI is InChI=1S/C8H14N2/c1-2-3-4-7-10-8-5-6-9/h4-8H,2-3,9H2,1H3/b6-5-,7-4+,10-8+.
What are the key properties of (Z)-3-[(E)-pent-1-enyl]iminoprop-1-en-1-amine?
(Z)-3-[(E)-pent-1-enyl]iminoprop-1-en-1-amine has a molecular weight of 138.21 g/mol, XLogP of 1.84, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-[(E)-pent-1-enyl]iminoprop-1-en-1-amine is sourced from PubChem (CID 163673678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).