N-methyl-1-piperidin-2-ylprop-2-en-1-imine

C9H16N2 — CID 123359089

IUPACN-methyl-1-piperidin-2-ylprop-2-en-1-imine
SMILESC=C/C(=N\C)C1CCCCN1
InChIInChI=1S/C9H16N2/c1-3-8(10-2)9-6-4-5-7-11-9/h3,9,11H,1,4-7H2,2H3/b10-8+
InChIKeyKUYOAFPGFKHWMP-CSKARUKUSA-N
MW152.24 g/mol
LogP1.39
Rot. Bonds2

About N-methyl-1-piperidin-2-ylprop-2-en-1-imine

N-methyl-1-piperidin-2-ylprop-2-en-1-imine (PubChem CID 123359089) has the molecular formula C9H16N2 and a molecular weight of 152.24 g/mol. Its IUPAC name is N-methyl-1-piperidin-2-ylprop-2-en-1-imine.

Molecular Properties

Compound NameN-methyl-1-piperidin-2-ylprop-2-en-1-imine
PubChem CID123359089
Molecular FormulaC9H16N2
Molecular Weight152.24 g/mol
Exact Mass152.13
IUPAC NameN-methyl-1-piperidin-2-ylprop-2-en-1-imine
SMILESC=C/C(=N\C)C1CCCCN1
InChIInChI=1S/C9H16N2/c1-3-8(10-2)9-6-4-5-7-11-9/h3,9,11H,1,4-7H2,2H3/b10-8+
InChIKeyKUYOAFPGFKHWMP-CSKARUKUSA-N
XLogP1.39
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-methyl-1-piperidin-2-ylprop-2-en-1-imine 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

N-methyl-3-(5-piperidin-3-ylpent-1-en-3-ylideneamino)propan-1-amine
CID 123250912
N-ethyl-3-methyliminooct-1-en-4-amine
CID 123344021
1-Piperidin-2-ylprop-2-en-1-imine
CID 124036181
but-3-en-2-imine;ethane;N-methylpiperidin-4-amine
CID 145006356
N-ethenyl-2-methyl-1-piperidin-2-ylprop-2-en-1-imine
CID 145424920
1-(3,4-dihydropyridin-2-yl)-N-methylpropan-1-amine;ethane
CID 155735826
N-methyl-1-piperidin-4-ylprop-2-en-1-imine
CID 171849703
N,2-dimethyl-3-methylidenepiperidin-4-imine
CID 176925363
1-(3,4-dihydropyridin-2-yl)-N-methylpropan-1-amine
CID 155735827

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-piperidin-2-ylprop-2-en-1-imine?
The IUPAC name of N-methyl-1-piperidin-2-ylprop-2-en-1-imine (CID 123359089) is N-methyl-1-piperidin-2-ylprop-2-en-1-imine.
What is the SMILES notation for N-methyl-1-piperidin-2-ylprop-2-en-1-imine?
The canonical SMILES for N-methyl-1-piperidin-2-ylprop-2-en-1-imine is C=C/C(=N\C)C1CCCCN1.
What is the InChIKey of N-methyl-1-piperidin-2-ylprop-2-en-1-imine?
The InChIKey is KUYOAFPGFKHWMP-CSKARUKUSA-N. The full InChI is InChI=1S/C9H16N2/c1-3-8(10-2)9-6-4-5-7-11-9/h3,9,11H,1,4-7H2,2H3/b10-8+.
What are the key properties of N-methyl-1-piperidin-2-ylprop-2-en-1-imine?
N-methyl-1-piperidin-2-ylprop-2-en-1-imine has a molecular weight of 152.24 g/mol, XLogP of 1.39, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-piperidin-2-ylprop-2-en-1-imine is sourced from PubChem (CID 123359089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).