1-(2-methoxyethyl)-N-(4-methylhexan-2-yl)imidazol-2-amine

C13H25N3O — CID 106574023

IUPAC1-(2-methoxyethyl)-N-(4-methylhexan-2-yl)imidazol-2-amine
SMILESCCC(C)CC(C)Nc1nccn1CCOC
InChIInChI=1S/C13H25N3O/c1-5-11(2)10-12(3)15-13-14-6-7-16(13)8-9-17-4/h6-7,11-12H,5,8-10H2,1-4H3,(H,14,15)
InChIKeyKUPMBJJZVLDPON-UHFFFAOYSA-N
MW239.36 g/mol
LogP2.77
Rot. Bonds8

About 1-(2-methoxyethyl)-N-(4-methylhexan-2-yl)imidazol-2-amine

1-(2-methoxyethyl)-N-(4-methylhexan-2-yl)imidazol-2-amine (PubChem CID 106574023) has the molecular formula C13H25N3O and a molecular weight of 239.36 g/mol. Its IUPAC name is 1-(2-methoxyethyl)-N-(4-methylhexan-2-yl)imidazol-2-amine.

Molecular Properties

Compound Name1-(2-methoxyethyl)-N-(4-methylhexan-2-yl)imidazol-2-amine
PubChem CID106574023
Molecular FormulaC13H25N3O
Molecular Weight239.36 g/mol
Exact Mass239.20
IUPAC Name1-(2-methoxyethyl)-N-(4-methylhexan-2-yl)imidazol-2-amine
SMILESCCC(C)CC(C)Nc1nccn1CCOC
InChIInChI=1S/C13H25N3O/c1-5-11(2)10-12(3)15-13-14-6-7-16(13)8-9-17-4/h6-7,11-12H,5,8-10H2,1-4H3,(H,14,15)
InChIKeyKUPMBJJZVLDPON-UHFFFAOYSA-N
XLogP2.77
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2-methoxyethyl)-N-(4-methylpentan-2-yl)imidazol-2-amine
CID 106561717
N-(1-methoxypropan-2-yl)-1-[2-(2-methylpropoxy)ethyl]imidazol-2-amine
CID 106582356
N-(1-methoxypropan-2-yl)-1-(3-methylbutyl)imidazol-2-amine
CID 106557283
1-(3-methoxypropyl)-N-propan-2-ylimidazol-2-amine
CID 106554826
1-(2-methoxyethyl)-N-(3-methyl-2-propan-2-ylbutyl)imidazol-2-amine
CID 106582922
N-(1-methoxypropan-2-yl)-1-(3-methylsulfanylbutyl)imidazol-2-amine
CID 106581674
N-(1-ethoxypropan-2-yl)-1-propylimidazol-2-amine
CID 106565346
N-(1-methoxypropan-2-yl)-1-(3-pyrrolidin-1-ylpropyl)imidazol-2-amine
CID 106572044
1-(2-butoxyethyl)-N-propan-2-ylimidazol-2-amine
CID 106568327
N-(cyclobutylmethyl)-1-(2-methoxyethyl)imidazol-2-amine
CID 106561470
1-butyl-N-(3-methylpentan-2-yl)imidazol-2-amine
CID 106564650
N-ethyl-1-[2-(2-methoxyethoxy)ethyl]imidazol-2-amine
CID 106564453

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethyl)-N-(4-methylhexan-2-yl)imidazol-2-amine?
The IUPAC name of 1-(2-methoxyethyl)-N-(4-methylhexan-2-yl)imidazol-2-amine (CID 106574023) is 1-(2-methoxyethyl)-N-(4-methylhexan-2-yl)imidazol-2-amine.
What is the SMILES notation for 1-(2-methoxyethyl)-N-(4-methylhexan-2-yl)imidazol-2-amine?
The canonical SMILES for 1-(2-methoxyethyl)-N-(4-methylhexan-2-yl)imidazol-2-amine is CCC(C)CC(C)Nc1nccn1CCOC.
What is the InChIKey of 1-(2-methoxyethyl)-N-(4-methylhexan-2-yl)imidazol-2-amine?
The InChIKey is KUPMBJJZVLDPON-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O/c1-5-11(2)10-12(3)15-13-14-6-7-16(13)8-9-17-4/h6-7,11-12H,5,8-10H2,1-4H3,(H,14,15).
What are the key properties of 1-(2-methoxyethyl)-N-(4-methylhexan-2-yl)imidazol-2-amine?
1-(2-methoxyethyl)-N-(4-methylhexan-2-yl)imidazol-2-amine has a molecular weight of 239.36 g/mol, XLogP of 2.77, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethyl)-N-(4-methylhexan-2-yl)imidazol-2-amine is sourced from PubChem (CID 106574023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).