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

C12H20N2 — CID 156727096

IUPACN-[(Z)-3-methylidene-1-piperidin-1-ylpent-1-enyl]methanimine
SMILESC=N/C(=C\C(=C)CC)N1CCCCC1
InChIInChI=1S/C12H20N2/c1-4-11(2)10-12(13-3)14-8-6-5-7-9-14/h10H,2-9H2,1H3/b12-10+
InChIKeyOUIKTBGMFLBHNW-ZRDIBKRKSA-N
MW192.31 g/mol
LogP2.98
Rot. Bonds4

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

N-[(Z)-3-methylidene-1-piperidin-1-ylpent-1-enyl]methanimine (PubChem CID 156727096) has the molecular formula C12H20N2 and a molecular weight of 192.31 g/mol. Its IUPAC name is N-[(Z)-3-methylidene-1-piperidin-1-ylpent-1-enyl]methanimine.

Molecular Properties

Compound NameN-[(Z)-3-methylidene-1-piperidin-1-ylpent-1-enyl]methanimine
PubChem CID156727096
Molecular FormulaC12H20N2
Molecular Weight192.31 g/mol
Exact Mass192.16
IUPAC NameN-[(Z)-3-methylidene-1-piperidin-1-ylpent-1-enyl]methanimine
SMILESC=N/C(=C\C(=C)CC)N1CCCCC1
InChIInChI=1S/C12H20N2/c1-4-11(2)10-12(13-3)14-8-6-5-7-9-14/h10H,2-9H2,1H3/b12-10+
InChIKeyOUIKTBGMFLBHNW-ZRDIBKRKSA-N
XLogP2.98
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.31
LogP ≤ 52.98
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-[(1Z,3Z)-3-methyl-1-(4-methylpiperidin-1-yl)penta-1,3-dienyl]methanimine
CID 132150718
ethane;N-[(1Z)-3-methyl-1-(4-methylpiperazin-1-yl)buta-1,3-dienyl]methanimine
CID 142345667
ethane;N-(5-ethenyl-1-methyl-3,4-dihydro-2H-pyridin-6-yl)methanimine
CID 142619167
(1Z)-N-ethyl-3-methyl-1-(methylideneamino)-N-propylbuta-1,3-dien-1-amine
CID 144023824
N-[(1Z)-1-piperidin-1-ylbuta-1,3-dienyl]methanimine
CID 144753254
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
N-[(Z)-4-methyl-3-methylidene-1-piperidin-1-ylpent-1-enyl]methanimine
CID 156726917
N-[(1Z)-3-methyl-1-(4-methylpiperazin-1-yl)buta-1,3-dienyl]methanimine
CID 142345668
N-(5-ethenyl-1-methyl-3,4-dihydro-2H-pyridin-6-yl)methanimine
CID 142619168
(Z)-2-methyl-N-[(E)-1-piperidin-1-ylbut-1-enyl]prop-2-en-1-imine
CID 144598575
N-[(1Z)-2-methyl-1-piperidin-1-ylbuta-1,3-dienyl]methanimine
CID 145613961

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-3-methylidene-1-piperidin-1-ylpent-1-enyl]methanimine?
The IUPAC name of N-[(Z)-3-methylidene-1-piperidin-1-ylpent-1-enyl]methanimine (CID 156727096) is N-[(Z)-3-methylidene-1-piperidin-1-ylpent-1-enyl]methanimine.
What is the SMILES notation for N-[(Z)-3-methylidene-1-piperidin-1-ylpent-1-enyl]methanimine?
The canonical SMILES for N-[(Z)-3-methylidene-1-piperidin-1-ylpent-1-enyl]methanimine is C=N/C(=C\C(=C)CC)N1CCCCC1.
What is the InChIKey of N-[(Z)-3-methylidene-1-piperidin-1-ylpent-1-enyl]methanimine?
The InChIKey is OUIKTBGMFLBHNW-ZRDIBKRKSA-N. The full InChI is InChI=1S/C12H20N2/c1-4-11(2)10-12(13-3)14-8-6-5-7-9-14/h10H,2-9H2,1H3/b12-10+.
What are the key properties of N-[(Z)-3-methylidene-1-piperidin-1-ylpent-1-enyl]methanimine?
N-[(Z)-3-methylidene-1-piperidin-1-ylpent-1-enyl]methanimine has a molecular weight of 192.31 g/mol, XLogP of 2.98, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-3-methylidene-1-piperidin-1-ylpent-1-enyl]methanimine is sourced from PubChem (CID 156727096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).