(Z)-N-methylhex-2-en-1-imine;pentane

C12H25N — CID 143714813

IUPAC(Z)-N-methylhex-2-en-1-imine;pentane
SMILESCCC/C=C\C=N\C.CCCCC
InChIInChI=1S/C7H13N.C5H12/c1-3-4-5-6-7-8-2;1-3-5-4-2/h5-7H,3-4H2,1-2H3;3-5H2,1-2H3/b6-5-,8-7+;
InChIKeyPTISZLWWFOOAGG-DUZKJZLISA-N
MW183.34 g/mol
LogP4.24
Rot. Bonds5

About (Z)-N-methylhex-2-en-1-imine;pentane

(Z)-N-methylhex-2-en-1-imine;pentane (PubChem CID 143714813) has the molecular formula C12H25N and a molecular weight of 183.34 g/mol. Its IUPAC name is (Z)-N-methylhex-2-en-1-imine;pentane.

Molecular Properties

Compound Name(Z)-N-methylhex-2-en-1-imine;pentane
PubChem CID143714813
Molecular FormulaC12H25N
Molecular Weight183.34 g/mol
Exact Mass183.20
IUPAC Name(Z)-N-methylhex-2-en-1-imine;pentane
SMILESCCC/C=C\C=N\C.CCCCC
InChIInChI=1S/C7H13N.C5H12/c1-3-4-5-6-7-8-2;1-3-5-4-2/h5-7H,3-4H2,1-2H3;3-5H2,1-2H3/b6-5-,8-7+;
InChIKeyPTISZLWWFOOAGG-DUZKJZLISA-N
XLogP4.24
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.34
LogP ≤ 54.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze (Z)-N-methylhex-2-en-1-imine;pentane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-Methyl-2,3-dihydropyridine
CID 21652564
2-Propyl-2,3-dihydropyridine
CID 68521817
(Z,5S)-N-ethyl-5-fluoro-6-methylhept-2-en-1-imine
CID 129037792
(E,E)-N-(trimethylsilylmethyl)pent-2-en-1-imine
CID 10997456
N-(2-ethyl-2-hexenylidene)propylamine
CID 129806324
(E)-N,5-dimethyl-4-propan-2-ylhex-2-en-1-imine
CID 134895402
(2E,5E)-N-tert-butyl-3,7-dimethylocta-2,5-dien-1-imine
CID 135053282
(E)-N-tert-butyl-4,4-dimethylpent-2-en-1-imine
CID 10464698
(E)-N,N'-dipentylpent-2-ene-1,5-diimine
CID 19025926
(4Z,8Z)-1-azacyclododeca-4,8,12-triene
CID 20405358
(E)-4-methyl-N-propan-2-ylpent-2-en-1-imine
CID 22086824
(6Z)-2,3,4,5-tetrahydroazocine
CID 22238061

Frequently Asked Questions

What is the IUPAC name of (Z)-N-methylhex-2-en-1-imine;pentane?
The IUPAC name of (Z)-N-methylhex-2-en-1-imine;pentane (CID 143714813) is (Z)-N-methylhex-2-en-1-imine;pentane.
What is the SMILES notation for (Z)-N-methylhex-2-en-1-imine;pentane?
The canonical SMILES for (Z)-N-methylhex-2-en-1-imine;pentane is CCC/C=C\C=N\C.CCCCC.
What is the InChIKey of (Z)-N-methylhex-2-en-1-imine;pentane?
The InChIKey is PTISZLWWFOOAGG-DUZKJZLISA-N. The full InChI is InChI=1S/C7H13N.C5H12/c1-3-4-5-6-7-8-2;1-3-5-4-2/h5-7H,3-4H2,1-2H3;3-5H2,1-2H3/b6-5-,8-7+;.
What are the key properties of (Z)-N-methylhex-2-en-1-imine;pentane?
(Z)-N-methylhex-2-en-1-imine;pentane has a molecular weight of 183.34 g/mol, XLogP of 4.24, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-methylhex-2-en-1-imine;pentane is sourced from PubChem (CID 143714813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).