N-methyl-1-(1-methylimidazol-4-yl)hexan-1-amine

C11H21N3 — CID 107974330

IUPACN-methyl-1-(1-methylimidazol-4-yl)hexan-1-amine
SMILESCCCCCC(NC)c1cn(C)cn1
InChIInChI=1S/C11H21N3/c1-4-5-6-7-10(12-2)11-8-14(3)9-13-11/h8-10,12H,4-7H2,1-3H3
InChIKeySIEXMJTWFYVPFZ-UHFFFAOYSA-N
MW195.31 g/mol
LogP2.26
Rot. Bonds6

About N-methyl-1-(1-methylimidazol-4-yl)hexan-1-amine

N-methyl-1-(1-methylimidazol-4-yl)hexan-1-amine (PubChem CID 107974330) has the molecular formula C11H21N3 and a molecular weight of 195.31 g/mol. Its IUPAC name is N-methyl-1-(1-methylimidazol-4-yl)hexan-1-amine.

Molecular Properties

Compound NameN-methyl-1-(1-methylimidazol-4-yl)hexan-1-amine
PubChem CID107974330
Molecular FormulaC11H21N3
Molecular Weight195.31 g/mol
Exact Mass195.17
IUPAC NameN-methyl-1-(1-methylimidazol-4-yl)hexan-1-amine
SMILESCCCCCC(NC)c1cn(C)cn1
InChIInChI=1S/C11H21N3/c1-4-5-6-7-10(12-2)11-8-14(3)9-13-11/h8-10,12H,4-7H2,1-3H3
InChIKeySIEXMJTWFYVPFZ-UHFFFAOYSA-N
XLogP2.26
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.31
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-methyl-1-(1-methylimidazol-4-yl)heptan-1-amine
CID 107974273
1-(1-methylimidazol-4-yl)undecylhydrazine
CID 107979020
N-methyl-1-(1-methylimidazol-4-yl)hex-5-en-1-amine
CID 107975594
4-dodecan-5-yl-1-methylimidazole
CID 138655717
1-(1-methylimidazol-4-yl)nonan-1-amine
CID 107974313
N-methyl-1-(1-methylpyrazol-3-yl)heptan-1-amine
CID 65200418
1-(1-methylimidazol-4-yl)-N-propyloct-7-en-1-amine
CID 114023315
N-ethyl-4-methoxy-1-(1-methylimidazol-4-yl)butan-1-amine
CID 107977818
N-methyl-1-pyrimidin-2-ylundecan-1-amine
CID 62600438
N-ethyl-1-(1-methylimidazol-4-yl)propan-1-amine
CID 107973398
1-(1-methylimidazol-4-yl)propylhydrazine
CID 107978847
N-ethyl-1-(1-methylimidazol-4-yl)hex-5-en-1-amine
CID 107975605

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(1-methylimidazol-4-yl)hexan-1-amine?
The IUPAC name of N-methyl-1-(1-methylimidazol-4-yl)hexan-1-amine (CID 107974330) is N-methyl-1-(1-methylimidazol-4-yl)hexan-1-amine.
What is the SMILES notation for N-methyl-1-(1-methylimidazol-4-yl)hexan-1-amine?
The canonical SMILES for N-methyl-1-(1-methylimidazol-4-yl)hexan-1-amine is CCCCCC(NC)c1cn(C)cn1.
What is the InChIKey of N-methyl-1-(1-methylimidazol-4-yl)hexan-1-amine?
The InChIKey is SIEXMJTWFYVPFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3/c1-4-5-6-7-10(12-2)11-8-14(3)9-13-11/h8-10,12H,4-7H2,1-3H3.
What are the key properties of N-methyl-1-(1-methylimidazol-4-yl)hexan-1-amine?
N-methyl-1-(1-methylimidazol-4-yl)hexan-1-amine has a molecular weight of 195.31 g/mol, XLogP of 2.26, 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)hexan-1-amine is sourced from PubChem (CID 107974330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).