N-(2-methylprop-2-enyl)-1-pyridin-3-ylmethanimine

C10H12N2 — CID 142604700

IUPACN-(2-methylprop-2-enyl)-1-pyridin-3-ylmethanimine
SMILESC=C(C)C/N=C/c1cccnc1
InChIInChI=1S/C10H12N2/c1-9(2)6-12-8-10-4-3-5-11-7-10/h3-5,7-8H,1,6H2,2H3/b12-8+
InChIKeyYWSAQXRNZGYHTC-XYOKQWHBSA-N
MW160.22 g/mol
LogP2.08
Rot. Bonds3

About N-(2-methylprop-2-enyl)-1-pyridin-3-ylmethanimine

N-(2-methylprop-2-enyl)-1-pyridin-3-ylmethanimine (PubChem CID 142604700) has the molecular formula C10H12N2 and a molecular weight of 160.22 g/mol. Its IUPAC name is N-(2-methylprop-2-enyl)-1-pyridin-3-ylmethanimine.

Molecular Properties

Compound NameN-(2-methylprop-2-enyl)-1-pyridin-3-ylmethanimine
PubChem CID142604700
Molecular FormulaC10H12N2
Molecular Weight160.22 g/mol
Exact Mass160.10
IUPAC NameN-(2-methylprop-2-enyl)-1-pyridin-3-ylmethanimine
SMILESC=C(C)C/N=C/c1cccnc1
InChIInChI=1S/C10H12N2/c1-9(2)6-12-8-10-4-3-5-11-7-10/h3-5,7-8H,1,6H2,2H3/b12-8+
InChIKeyYWSAQXRNZGYHTC-XYOKQWHBSA-N
XLogP2.08
TPSA25.25 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.22
LogP ≤ 52.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-(2-methylprop-2-enyl)-1-pyridin-3-ylmethanimine 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-(pyridin-3-ylmethylideneamino)acetic acid
CID 45082526
1-(4-methylphenyl)-2-(pyridin-3-ylmethylideneamino)ethanone
CID 160987415
1-pyridin-3-yl-N-(1-trimethylsilyloxyethenyl)methanimine
CID 70263922
1-(4-methylphenyl)-N-(2-methylprop-2-enyl)methanimine
CID 15208611
2-(pyridin-3-ylmethylideneamino)-N,N-bis[2-(pyridin-3-ylmethylideneamino)ethyl]ethanamine
CID 69234303
3-[(1Z)-2-methylbuta-1,3-dienyl]pyridine
CID 45079882
N-[(E)-4-(pentamethyl-λ6-sulfanyl)but-3-enyl]-1-pyridin-3-ylmethanimine
CID 166917905
tert-butyl (NE)-N-(pyridin-3-ylmethylidene)carbamate
CID 11481157
CID 131858610
CID 131858610
N-phenyl-N-(pyridin-3-ylmethylideneamino)aniline
CID 4985790
2-[(E)-pyridin-3-ylmethylideneamino]guanidine;hydrochloride
CID 54609066
methyl N'-[(Z)-pyridin-3-ylmethylideneamino]carbamimidothioate
CID 6850946

Frequently Asked Questions

What is the IUPAC name of N-(2-methylprop-2-enyl)-1-pyridin-3-ylmethanimine?
The IUPAC name of N-(2-methylprop-2-enyl)-1-pyridin-3-ylmethanimine (CID 142604700) is N-(2-methylprop-2-enyl)-1-pyridin-3-ylmethanimine.
What is the SMILES notation for N-(2-methylprop-2-enyl)-1-pyridin-3-ylmethanimine?
The canonical SMILES for N-(2-methylprop-2-enyl)-1-pyridin-3-ylmethanimine is C=C(C)C/N=C/c1cccnc1.
What is the InChIKey of N-(2-methylprop-2-enyl)-1-pyridin-3-ylmethanimine?
The InChIKey is YWSAQXRNZGYHTC-XYOKQWHBSA-N. The full InChI is InChI=1S/C10H12N2/c1-9(2)6-12-8-10-4-3-5-11-7-10/h3-5,7-8H,1,6H2,2H3/b12-8+.
What are the key properties of N-(2-methylprop-2-enyl)-1-pyridin-3-ylmethanimine?
N-(2-methylprop-2-enyl)-1-pyridin-3-ylmethanimine has a molecular weight of 160.22 g/mol, XLogP of 2.08, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylprop-2-enyl)-1-pyridin-3-ylmethanimine is sourced from PubChem (CID 142604700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).