1,5-dimethyl-N-(2-methylpropyl)-2,4-dihydropyridin-3-imine

C11H20N2 — CID 56636914

IUPAC1,5-dimethyl-N-(2-methylpropyl)-2,4-dihydropyridin-3-imine
SMILESCC1=CN(C)C/C(=N/CC(C)C)C1
InChIInChI=1S/C11H20N2/c1-9(2)6-12-11-5-10(3)7-13(4)8-11/h7,9H,5-6,8H2,1-4H3/b12-11+
InChIKeyFPPGHGZBRUEPGO-VAWYXSNFSA-N
MW180.29 g/mol
LogP2.32
Rot. Bonds2

About 1,5-dimethyl-N-(2-methylpropyl)-2,4-dihydropyridin-3-imine

1,5-dimethyl-N-(2-methylpropyl)-2,4-dihydropyridin-3-imine (PubChem CID 56636914) has the molecular formula C11H20N2 and a molecular weight of 180.29 g/mol. Its IUPAC name is 1,5-dimethyl-N-(2-methylpropyl)-2,4-dihydropyridin-3-imine.

Molecular Properties

Compound Name1,5-dimethyl-N-(2-methylpropyl)-2,4-dihydropyridin-3-imine
PubChem CID56636914
Molecular FormulaC11H20N2
Molecular Weight180.29 g/mol
Exact Mass180.16
IUPAC Name1,5-dimethyl-N-(2-methylpropyl)-2,4-dihydropyridin-3-imine
SMILESCC1=CN(C)C/C(=N/CC(C)C)C1
InChIInChI=1S/C11H20N2/c1-9(2)6-12-11-5-10(3)7-13(4)8-11/h7,9H,5-6,8H2,1-4H3/b12-11+
InChIKeyFPPGHGZBRUEPGO-VAWYXSNFSA-N
XLogP2.32
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.29
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 1,5-dimethyl-N-(2-methylpropyl)-2,4-dihydropyridin-3-imine 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 1,5-dimethyl-N-(2-methylpropyl)-2,4-dihydropyridin-3-imine?
The IUPAC name of 1,5-dimethyl-N-(2-methylpropyl)-2,4-dihydropyridin-3-imine (CID 56636914) is 1,5-dimethyl-N-(2-methylpropyl)-2,4-dihydropyridin-3-imine.
What is the SMILES notation for 1,5-dimethyl-N-(2-methylpropyl)-2,4-dihydropyridin-3-imine?
The canonical SMILES for 1,5-dimethyl-N-(2-methylpropyl)-2,4-dihydropyridin-3-imine is CC1=CN(C)C/C(=N/CC(C)C)C1.
What is the InChIKey of 1,5-dimethyl-N-(2-methylpropyl)-2,4-dihydropyridin-3-imine?
The InChIKey is FPPGHGZBRUEPGO-VAWYXSNFSA-N. The full InChI is InChI=1S/C11H20N2/c1-9(2)6-12-11-5-10(3)7-13(4)8-11/h7,9H,5-6,8H2,1-4H3/b12-11+.
What are the key properties of 1,5-dimethyl-N-(2-methylpropyl)-2,4-dihydropyridin-3-imine?
1,5-dimethyl-N-(2-methylpropyl)-2,4-dihydropyridin-3-imine has a molecular weight of 180.29 g/mol, XLogP of 2.32, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dimethyl-N-(2-methylpropyl)-2,4-dihydropyridin-3-imine is sourced from PubChem (CID 56636914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).