N-methyl-1-(1-methylimidazol-4-yl)hex-5-en-1-amine

C11H19N3 — CID 107975594

IUPACN-methyl-1-(1-methylimidazol-4-yl)hex-5-en-1-amine
SMILESC=CCCCC(NC)c1cn(C)cn1
InChIInChI=1S/C11H19N3/c1-4-5-6-7-10(12-2)11-8-14(3)9-13-11/h4,8-10,12H,1,5-7H2,2-3H3
InChIKeyYZMSLXHIULRNMV-UHFFFAOYSA-N
MW193.29 g/mol
LogP2.04
Rot. Bonds6

About N-methyl-1-(1-methylimidazol-4-yl)hex-5-en-1-amine

N-methyl-1-(1-methylimidazol-4-yl)hex-5-en-1-amine (PubChem CID 107975594) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is N-methyl-1-(1-methylimidazol-4-yl)hex-5-en-1-amine.

Molecular Properties

Compound NameN-methyl-1-(1-methylimidazol-4-yl)hex-5-en-1-amine
PubChem CID107975594
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC NameN-methyl-1-(1-methylimidazol-4-yl)hex-5-en-1-amine
SMILESC=CCCCC(NC)c1cn(C)cn1
InChIInChI=1S/C11H19N3/c1-4-5-6-7-10(12-2)11-8-14(3)9-13-11/h4,8-10,12H,1,5-7H2,2-3H3
InChIKeyYZMSLXHIULRNMV-UHFFFAOYSA-N
XLogP2.04
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-ethyl-1-(1-methylimidazol-4-yl)hex-5-en-1-amine
CID 107975605
N-methyl-1-(1-methylimidazol-4-yl)hexan-1-amine
CID 107974330
N-methyl-1-(1-methylimidazol-4-yl)heptan-1-amine
CID 107974273
1-(1-methylimidazol-4-yl)-N-propyloct-7-en-1-amine
CID 114023315
1-(1-methylimidazol-4-yl)pent-4-enylhydrazine
CID 107979159
1-(1-methylimidazol-4-yl)oct-7-en-1-ol
CID 107978815
N-methyl-1-(1-methylpyrazol-3-yl)oct-7-en-1-amine
CID 107009195
1-(1-methylimidazol-4-yl)-N-propylbut-3-en-1-amine
CID 107973946
1-(3-ethyl-1-methylpyrazol-4-yl)-N-methyloct-7-en-1-amine
CID 107011544
1-(5-fluoro-2-pyridinyl)-N-methyloct-7-en-1-amine
CID 107009456
1-(1-methylimidazol-4-yl)undecylhydrazine
CID 107979020
1-(5-bromo-2-pyridinyl)-N-methyloct-7-en-1-amine
CID 107009654

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(1-methylimidazol-4-yl)hex-5-en-1-amine?
The IUPAC name of N-methyl-1-(1-methylimidazol-4-yl)hex-5-en-1-amine (CID 107975594) is N-methyl-1-(1-methylimidazol-4-yl)hex-5-en-1-amine.
What is the SMILES notation for N-methyl-1-(1-methylimidazol-4-yl)hex-5-en-1-amine?
The canonical SMILES for N-methyl-1-(1-methylimidazol-4-yl)hex-5-en-1-amine is C=CCCCC(NC)c1cn(C)cn1.
What is the InChIKey of N-methyl-1-(1-methylimidazol-4-yl)hex-5-en-1-amine?
The InChIKey is YZMSLXHIULRNMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c1-4-5-6-7-10(12-2)11-8-14(3)9-13-11/h4,8-10,12H,1,5-7H2,2-3H3.
What are the key properties of N-methyl-1-(1-methylimidazol-4-yl)hex-5-en-1-amine?
N-methyl-1-(1-methylimidazol-4-yl)hex-5-en-1-amine has a molecular weight of 193.29 g/mol, XLogP of 2.04, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(1-methylimidazol-4-yl)hex-5-en-1-amine is sourced from PubChem (CID 107975594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).