N-[1-methyl-4-[(Z)-prop-1-enyl]-2,5-dihydropyrrol-3-yl]methanimine

C9H14N2 — CID 134286368

IUPACN-[1-methyl-4-[(Z)-prop-1-enyl]-2,5-dihydropyrrol-3-yl]methanimine
SMILESC=NC1=C(/C=C\C)CN(C)C1
InChIInChI=1S/C9H14N2/c1-4-5-8-6-11(3)7-9(8)10-2/h4-5H,2,6-7H2,1,3H3/b5-4-
InChIKeyIUWSBOGAUYCCBV-PLNGDYQASA-N
MW150.22 g/mol
LogP1.46
Rot. Bonds2

About N-[1-methyl-4-[(Z)-prop-1-enyl]-2,5-dihydropyrrol-3-yl]methanimine

N-[1-methyl-4-[(Z)-prop-1-enyl]-2,5-dihydropyrrol-3-yl]methanimine (PubChem CID 134286368) has the molecular formula C9H14N2 and a molecular weight of 150.22 g/mol. Its IUPAC name is N-[1-methyl-4-[(Z)-prop-1-enyl]-2,5-dihydropyrrol-3-yl]methanimine.

Molecular Properties

Compound NameN-[1-methyl-4-[(Z)-prop-1-enyl]-2,5-dihydropyrrol-3-yl]methanimine
PubChem CID134286368
Molecular FormulaC9H14N2
Molecular Weight150.22 g/mol
Exact Mass150.12
IUPAC NameN-[1-methyl-4-[(Z)-prop-1-enyl]-2,5-dihydropyrrol-3-yl]methanimine
SMILESC=NC1=C(/C=C\C)CN(C)C1
InChIInChI=1S/C9H14N2/c1-4-5-8-6-11(3)7-9(8)10-2/h4-5H,2,6-7H2,1,3H3/b5-4-
InChIKeyIUWSBOGAUYCCBV-PLNGDYQASA-N
XLogP1.46
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.22
LogP ≤ 51.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-[1-methyl-4-[(Z)-prop-1-enyl]-2,5-dihydropyrrol-3-yl]methanimine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[1-methyl-4-[(Z)-prop-1-enyl]-2,5-dihydropyrrol-3-yl]methanimine?
The IUPAC name of N-[1-methyl-4-[(Z)-prop-1-enyl]-2,5-dihydropyrrol-3-yl]methanimine (CID 134286368) is N-[1-methyl-4-[(Z)-prop-1-enyl]-2,5-dihydropyrrol-3-yl]methanimine.
What is the SMILES notation for N-[1-methyl-4-[(Z)-prop-1-enyl]-2,5-dihydropyrrol-3-yl]methanimine?
The canonical SMILES for N-[1-methyl-4-[(Z)-prop-1-enyl]-2,5-dihydropyrrol-3-yl]methanimine is C=NC1=C(/C=C\C)CN(C)C1.
What is the InChIKey of N-[1-methyl-4-[(Z)-prop-1-enyl]-2,5-dihydropyrrol-3-yl]methanimine?
The InChIKey is IUWSBOGAUYCCBV-PLNGDYQASA-N. The full InChI is InChI=1S/C9H14N2/c1-4-5-8-6-11(3)7-9(8)10-2/h4-5H,2,6-7H2,1,3H3/b5-4-.
What are the key properties of N-[1-methyl-4-[(Z)-prop-1-enyl]-2,5-dihydropyrrol-3-yl]methanimine?
N-[1-methyl-4-[(Z)-prop-1-enyl]-2,5-dihydropyrrol-3-yl]methanimine has a molecular weight of 150.22 g/mol, XLogP of 1.46, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-methyl-4-[(Z)-prop-1-enyl]-2,5-dihydropyrrol-3-yl]methanimine is sourced from PubChem (CID 134286368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).