N-[(Z)-4-methyl-3-methylidene-1-piperidin-1-ylpent-1-enyl]methanimine

C13H22N2 — CID 156726917

IUPACN-[(Z)-4-methyl-3-methylidene-1-piperidin-1-ylpent-1-enyl]methanimine
SMILESC=N/C(=C\C(=C)C(C)C)N1CCCCC1
InChIInChI=1S/C13H22N2/c1-11(2)12(3)10-13(14-4)15-8-6-5-7-9-15/h10-11H,3-9H2,1-2H3/b13-10+
InChIKeyKTCHMIRPUMTETK-JLHYYAGUSA-N
MW206.33 g/mol
LogP3.23
Rot. Bonds4

About N-[(Z)-4-methyl-3-methylidene-1-piperidin-1-ylpent-1-enyl]methanimine

N-[(Z)-4-methyl-3-methylidene-1-piperidin-1-ylpent-1-enyl]methanimine (PubChem CID 156726917) has the molecular formula C13H22N2 and a molecular weight of 206.33 g/mol. Its IUPAC name is N-[(Z)-4-methyl-3-methylidene-1-piperidin-1-ylpent-1-enyl]methanimine.

Molecular Properties

Compound NameN-[(Z)-4-methyl-3-methylidene-1-piperidin-1-ylpent-1-enyl]methanimine
PubChem CID156726917
Molecular FormulaC13H22N2
Molecular Weight206.33 g/mol
Exact Mass206.18
IUPAC NameN-[(Z)-4-methyl-3-methylidene-1-piperidin-1-ylpent-1-enyl]methanimine
SMILESC=N/C(=C\C(=C)C(C)C)N1CCCCC1
InChIInChI=1S/C13H22N2/c1-11(2)12(3)10-13(14-4)15-8-6-5-7-9-15/h10-11H,3-9H2,1-2H3/b13-10+
InChIKeyKTCHMIRPUMTETK-JLHYYAGUSA-N
XLogP3.23
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.33
LogP ≤ 53.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[1-(4-methylpiperidin-1-yl)buta-1,3-dienyl]methanimine
CID 91333878
N-[(1Z,3Z)-3-methyl-1-(4-methylpiperidin-1-yl)penta-1,3-dienyl]methanimine
CID 132150718
N-[(1Z)-1-(4-methylpiperidin-1-yl)buta-1,3-dienyl]methanimine;propane
CID 143028537
ethane;N-[(1Z)-3-(1-ethylpiperidin-3-yl)buta-1,3-dienyl]methanimine
CID 144778371
(1E)-3-methyl-1-(4-methylpiperidin-1-yl)buta-1,3-dien-1-amine
CID 144921620
butane;N-[(1Z)-2-methyl-1-piperidin-1-ylbuta-1,3-dienyl]methanimine
CID 145613960
ethane;N-[(1Z)-2-methyl-1-piperidin-1-ylbuta-1,3-dienyl]methanimine
CID 145614084
3-Methyl-6-piperidin-1-yl-3,4-dihydropyridine
CID 146281395
N-[(Z)-3-methylidene-1-piperidin-1-ylpent-1-enyl]methanimine
CID 156727096
N-[(1Z)-1-(4-ethylpiperidin-1-yl)buta-1,3-dienyl]methanimine
CID 176699174
N-[(1Z)-1-(4-methylpiperidin-1-yl)buta-1,3-dienyl]methanimine
CID 143028538
N-[(1Z)-3-(1-ethylpiperidin-3-yl)buta-1,3-dienyl]methanimine
CID 144778372

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-4-methyl-3-methylidene-1-piperidin-1-ylpent-1-enyl]methanimine?
The IUPAC name of N-[(Z)-4-methyl-3-methylidene-1-piperidin-1-ylpent-1-enyl]methanimine (CID 156726917) is N-[(Z)-4-methyl-3-methylidene-1-piperidin-1-ylpent-1-enyl]methanimine.
What is the SMILES notation for N-[(Z)-4-methyl-3-methylidene-1-piperidin-1-ylpent-1-enyl]methanimine?
The canonical SMILES for N-[(Z)-4-methyl-3-methylidene-1-piperidin-1-ylpent-1-enyl]methanimine is C=N/C(=C\C(=C)C(C)C)N1CCCCC1.
What is the InChIKey of N-[(Z)-4-methyl-3-methylidene-1-piperidin-1-ylpent-1-enyl]methanimine?
The InChIKey is KTCHMIRPUMTETK-JLHYYAGUSA-N. The full InChI is InChI=1S/C13H22N2/c1-11(2)12(3)10-13(14-4)15-8-6-5-7-9-15/h10-11H,3-9H2,1-2H3/b13-10+.
What are the key properties of N-[(Z)-4-methyl-3-methylidene-1-piperidin-1-ylpent-1-enyl]methanimine?
N-[(Z)-4-methyl-3-methylidene-1-piperidin-1-ylpent-1-enyl]methanimine has a molecular weight of 206.33 g/mol, XLogP of 3.23, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-4-methyl-3-methylidene-1-piperidin-1-ylpent-1-enyl]methanimine is sourced from PubChem (CID 156726917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).