(Z)-3-N-methyl-1-N-methylidenepent-1-ene-1,3-diimine

C7H12N2 — CID 88570472

IUPAC(Z)-3-N-methyl-1-N-methylidenepent-1-ene-1,3-diimine
SMILESC=N/C=C\C(CC)=N\C
InChIInChI=1S/C7H12N2/c1-4-7(9-3)5-6-8-2/h5-6H,2,4H2,1,3H3/b6-5-,9-7+
InChIKeyWGWQQVQRWKJAIV-BZWSEGBZSA-N
MW124.19 g/mol
LogP1.68
Rot. Bonds3

About (Z)-3-N-methyl-1-N-methylidenepent-1-ene-1,3-diimine

(Z)-3-N-methyl-1-N-methylidenepent-1-ene-1,3-diimine (PubChem CID 88570472) has the molecular formula C7H12N2 and a molecular weight of 124.19 g/mol. Its IUPAC name is (Z)-3-N-methyl-1-N-methylidenepent-1-ene-1,3-diimine.

Molecular Properties

Compound Name(Z)-3-N-methyl-1-N-methylidenepent-1-ene-1,3-diimine
PubChem CID88570472
Molecular FormulaC7H12N2
Molecular Weight124.19 g/mol
Exact Mass124.10
IUPAC Name(Z)-3-N-methyl-1-N-methylidenepent-1-ene-1,3-diimine
SMILESC=N/C=C\C(CC)=N\C
InChIInChI=1S/C7H12N2/c1-4-7(9-3)5-6-8-2/h5-6H,2,4H2,1,3H3/b6-5-,9-7+
InChIKeyWGWQQVQRWKJAIV-BZWSEGBZSA-N
XLogP1.68
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.19
LogP ≤ 51.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze (Z)-3-N-methyl-1-N-methylidenepent-1-ene-1,3-diimine 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

4-Iminopyridine
CID 21297554
Pyridine-3,4-diimine
CID 22022782
Biazet
CID 91373211
N-methyl-methyl-3-pentenylidenimine
CID 123242629
(Z)-4-N-methylidene-2-N-(2,2,2-trifluoroethyl)but-3-ene-2,4-diimine
CID 130413505
N-ethenyl-2-fluoropent-1-en-3-imine
CID 172345409
N-propan-2-yl-4H-pyridin-3-imine
CID 19384805
N-methyl-3H-pyridin-4-imine
CID 20520378
N-propyl-3H-pyridin-4-imine
CID 20520388
4-diazo-3H-pyridine
CID 53668419
N,1-dimethyl-2,3-dihydropyridin-4-imine
CID 56625157
2-Ethylazete
CID 67261484

Frequently Asked Questions

What is the IUPAC name of (Z)-3-N-methyl-1-N-methylidenepent-1-ene-1,3-diimine?
The IUPAC name of (Z)-3-N-methyl-1-N-methylidenepent-1-ene-1,3-diimine (CID 88570472) is (Z)-3-N-methyl-1-N-methylidenepent-1-ene-1,3-diimine.
What is the SMILES notation for (Z)-3-N-methyl-1-N-methylidenepent-1-ene-1,3-diimine?
The canonical SMILES for (Z)-3-N-methyl-1-N-methylidenepent-1-ene-1,3-diimine is C=N/C=C\C(CC)=N\C.
What is the InChIKey of (Z)-3-N-methyl-1-N-methylidenepent-1-ene-1,3-diimine?
The InChIKey is WGWQQVQRWKJAIV-BZWSEGBZSA-N. The full InChI is InChI=1S/C7H12N2/c1-4-7(9-3)5-6-8-2/h5-6H,2,4H2,1,3H3/b6-5-,9-7+.
What are the key properties of (Z)-3-N-methyl-1-N-methylidenepent-1-ene-1,3-diimine?
(Z)-3-N-methyl-1-N-methylidenepent-1-ene-1,3-diimine has a molecular weight of 124.19 g/mol, XLogP of 1.68, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-N-methyl-1-N-methylidenepent-1-ene-1,3-diimine is sourced from PubChem (CID 88570472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).