(3Z)-N-methyl-3-prop-2-enylidenepiperidin-2-imine;propane

C12H22N2 — CID 143201854

IUPAC(3Z)-N-methyl-3-prop-2-enylidenepiperidin-2-imine;propane
SMILESC=C/C=C1/CCCN/C1=N\C.CCC
InChIInChI=1S/C9H14N2.C3H8/c1-3-5-8-6-4-7-11-9(8)10-2;1-3-2/h3,5H,1,4,6-7H2,2H3,(H,10,11);3H2,1-2H3/b8-5-;
InChIKeyOSLOCVBHYNVFKO-HGKIGUAWSA-N
MW194.32 g/mol
LogP2.93
Rot. Bonds1

About (3Z)-N-methyl-3-prop-2-enylidenepiperidin-2-imine;propane

(3Z)-N-methyl-3-prop-2-enylidenepiperidin-2-imine;propane (PubChem CID 143201854) has the molecular formula C12H22N2 and a molecular weight of 194.32 g/mol. Its IUPAC name is (3Z)-N-methyl-3-prop-2-enylidenepiperidin-2-imine;propane.

Molecular Properties

Compound Name(3Z)-N-methyl-3-prop-2-enylidenepiperidin-2-imine;propane
PubChem CID143201854
Molecular FormulaC12H22N2
Molecular Weight194.32 g/mol
Exact Mass194.18
IUPAC Name(3Z)-N-methyl-3-prop-2-enylidenepiperidin-2-imine;propane
SMILESC=C/C=C1/CCCN/C1=N\C.CCC
InChIInChI=1S/C9H14N2.C3H8/c1-3-5-8-6-4-7-11-9(8)10-2;1-3-2/h3,5H,1,4,6-7H2,2H3,(H,10,11);3H2,1-2H3/b8-5-;
InChIKeyOSLOCVBHYNVFKO-HGKIGUAWSA-N
XLogP2.93
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.32
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

ethane;(2Z)-N-methyl-2-prop-2-enylidenecyclopentan-1-imine
CID 143214227
(3E,4Z)-3,4-bis(prop-2-enylidene)azepane;ethane
CID 143328926
(1Z,2Z)-1-prop-2-enylidene-2-propylidenecyclohexane
CID 143194645
(3E,4Z)-3-ethylidene-4-prop-2-enylidenepiperidin-2-one;propane
CID 167479014
(2E)-3-methylidene-2-prop-2-enylidenepiperidine
CID 143834497
1-ethylidene-2-prop-2-enylidenecyclooctane
CID 91407681
ethane;(1Z,2Z)-1-ethylidene-2-prop-2-enylidenecycloheptane
CID 143924638
(Z)-N-(5-methyl-1,2,3,4-tetrahydropyridin-6-yl)hex-1-en-3-imine
CID 142348356
(3E,4Z)-4-ethylidene-3-prop-2-enylidenepiperidine
CID 135293785
ethane;(3E,4Z)-3-ethylidene-4-prop-2-enylidenepiperidine
CID 143519935
ethane;(1Z,2Z)-1-ethylidene-2-prop-2-enylidenecyclohexane;formamide;2-methylbutane
CID 144973587
N-[(Z)-[(2Z)-2-butan-2-ylidenepiperidin-3-ylidene]methyl]ethanimine
CID 142253748

Frequently Asked Questions

What is the IUPAC name of (3Z)-N-methyl-3-prop-2-enylidenepiperidin-2-imine;propane?
The IUPAC name of (3Z)-N-methyl-3-prop-2-enylidenepiperidin-2-imine;propane (CID 143201854) is (3Z)-N-methyl-3-prop-2-enylidenepiperidin-2-imine;propane.
What is the SMILES notation for (3Z)-N-methyl-3-prop-2-enylidenepiperidin-2-imine;propane?
The canonical SMILES for (3Z)-N-methyl-3-prop-2-enylidenepiperidin-2-imine;propane is C=C/C=C1/CCCN/C1=N\C.CCC.
What is the InChIKey of (3Z)-N-methyl-3-prop-2-enylidenepiperidin-2-imine;propane?
The InChIKey is OSLOCVBHYNVFKO-HGKIGUAWSA-N. The full InChI is InChI=1S/C9H14N2.C3H8/c1-3-5-8-6-4-7-11-9(8)10-2;1-3-2/h3,5H,1,4,6-7H2,2H3,(H,10,11);3H2,1-2H3/b8-5-;.
What are the key properties of (3Z)-N-methyl-3-prop-2-enylidenepiperidin-2-imine;propane?
(3Z)-N-methyl-3-prop-2-enylidenepiperidin-2-imine;propane has a molecular weight of 194.32 g/mol, XLogP of 2.93, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z)-N-methyl-3-prop-2-enylidenepiperidin-2-imine;propane is sourced from PubChem (CID 143201854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).