N-methyl-1-(5-methyl-1-prop-1-en-2-yl-3,4-dihydro-2H-pyridin-6-yl)methanimine

C11H18N2 — CID 134424576

IUPACN-methyl-1-(5-methyl-1-prop-1-en-2-yl-3,4-dihydro-2H-pyridin-6-yl)methanimine
SMILESC=C(C)N1CCCC(C)=C1/C=N/C
InChIInChI=1S/C11H18N2/c1-9(2)13-7-5-6-10(3)11(13)8-12-4/h8H,1,5-7H2,2-4H3/b12-8+
InChIKeyJNOMOQYOUDSTKQ-XYOKQWHBSA-N
MW178.28 g/mol
LogP2.59
Rot. Bonds2

About N-methyl-1-(5-methyl-1-prop-1-en-2-yl-3,4-dihydro-2H-pyridin-6-yl)methanimine

N-methyl-1-(5-methyl-1-prop-1-en-2-yl-3,4-dihydro-2H-pyridin-6-yl)methanimine (PubChem CID 134424576) has the molecular formula C11H18N2 and a molecular weight of 178.28 g/mol. Its IUPAC name is N-methyl-1-(5-methyl-1-prop-1-en-2-yl-3,4-dihydro-2H-pyridin-6-yl)methanimine.

Molecular Properties

Compound NameN-methyl-1-(5-methyl-1-prop-1-en-2-yl-3,4-dihydro-2H-pyridin-6-yl)methanimine
PubChem CID134424576
Molecular FormulaC11H18N2
Molecular Weight178.28 g/mol
Exact Mass178.15
IUPAC NameN-methyl-1-(5-methyl-1-prop-1-en-2-yl-3,4-dihydro-2H-pyridin-6-yl)methanimine
SMILESC=C(C)N1CCCC(C)=C1/C=N/C
InChIInChI=1S/C11H18N2/c1-9(2)13-7-5-6-10(3)11(13)8-12-4/h8H,1,5-7H2,2-4H3/b12-8+
InChIKeyJNOMOQYOUDSTKQ-XYOKQWHBSA-N
XLogP2.59
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.28
LogP ≤ 52.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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4-methyl-3-methylidene-6,7-dihydro-5H-cyclopenta[b]pyrazine
CID 89075766
N-butyl-N,6-dimethyl-1-methyliminohept-2-en-2-amine
CID 90735553
N,2,4,6-tetramethyl-N-(2-methyliminoethyl)hepta-2,6-dien-3-amine
CID 123380851
2-Methyl-7-propan-2-yl-1,3,4,5-tetrahydropyrido[3,4-c]azepine
CID 124009778
6-ethyl-1-prop-1-en-2-yl-3,4,5,6-tetrahydro-2H-1,7-naphthyridine
CID 134424563
(E)-N-methyl-3-piperidin-1-ylpent-2-en-1-imine
CID 142061223
(2E)-N,N-dimethyl-2-[3-(prop-1-en-2-yliminomethyl)buta-1,3-dien-2-yl]penta-2,4-dien-1-amine
CID 143030224
ethane;(2E)-N-methyl-2-(1-methyl-3-methylidenepiperidin-2-ylidene)ethanimine
CID 143610086
1-(1,4-dimethyl-3,6-dihydro-2H-pyridin-5-yl)-N-(3-methylbut-1-en-2-yl)methanimine
CID 145587891
8-Ethyl-6,7-dihydropyrrolo[1,2-a]pyrazine
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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(5-methyl-1-prop-1-en-2-yl-3,4-dihydro-2H-pyridin-6-yl)methanimine?
The IUPAC name of N-methyl-1-(5-methyl-1-prop-1-en-2-yl-3,4-dihydro-2H-pyridin-6-yl)methanimine (CID 134424576) is N-methyl-1-(5-methyl-1-prop-1-en-2-yl-3,4-dihydro-2H-pyridin-6-yl)methanimine.
What is the SMILES notation for N-methyl-1-(5-methyl-1-prop-1-en-2-yl-3,4-dihydro-2H-pyridin-6-yl)methanimine?
The canonical SMILES for N-methyl-1-(5-methyl-1-prop-1-en-2-yl-3,4-dihydro-2H-pyridin-6-yl)methanimine is C=C(C)N1CCCC(C)=C1/C=N/C.
What is the InChIKey of N-methyl-1-(5-methyl-1-prop-1-en-2-yl-3,4-dihydro-2H-pyridin-6-yl)methanimine?
The InChIKey is JNOMOQYOUDSTKQ-XYOKQWHBSA-N. The full InChI is InChI=1S/C11H18N2/c1-9(2)13-7-5-6-10(3)11(13)8-12-4/h8H,1,5-7H2,2-4H3/b12-8+.
What are the key properties of N-methyl-1-(5-methyl-1-prop-1-en-2-yl-3,4-dihydro-2H-pyridin-6-yl)methanimine?
N-methyl-1-(5-methyl-1-prop-1-en-2-yl-3,4-dihydro-2H-pyridin-6-yl)methanimine has a molecular weight of 178.28 g/mol, XLogP of 2.59, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(5-methyl-1-prop-1-en-2-yl-3,4-dihydro-2H-pyridin-6-yl)methanimine is sourced from PubChem (CID 134424576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).