1-[3-(2-methoxyethyl)imidazol-4-yl]-2-methylpropan-1-amine

C10H19N3O — CID 102969486

IUPAC1-[3-(2-methoxyethyl)imidazol-4-yl]-2-methylpropan-1-amine
SMILESCOCCn1cncc1C(N)C(C)C
InChIInChI=1S/C10H19N3O/c1-8(2)10(11)9-6-12-7-13(9)4-5-14-3/h6-8,10H,4-5,11H2,1-3H3
InChIKeyZULROTCSLFPAIX-UHFFFAOYSA-N
MW197.28 g/mol
LogP1.19
Rot. Bonds5

About 1-[3-(2-methoxyethyl)imidazol-4-yl]-2-methylpropan-1-amine

1-[3-(2-methoxyethyl)imidazol-4-yl]-2-methylpropan-1-amine (PubChem CID 102969486) has the molecular formula C10H19N3O and a molecular weight of 197.28 g/mol. Its IUPAC name is 1-[3-(2-methoxyethyl)imidazol-4-yl]-2-methylpropan-1-amine.

Molecular Properties

Compound Name1-[3-(2-methoxyethyl)imidazol-4-yl]-2-methylpropan-1-amine
PubChem CID102969486
Molecular FormulaC10H19N3O
Molecular Weight197.28 g/mol
Exact Mass197.15
IUPAC Name1-[3-(2-methoxyethyl)imidazol-4-yl]-2-methylpropan-1-amine
SMILESCOCCn1cncc1C(N)C(C)C
InChIInChI=1S/C10H19N3O/c1-8(2)10(11)9-6-12-7-13(9)4-5-14-3/h6-8,10H,4-5,11H2,1-3H3
InChIKeyZULROTCSLFPAIX-UHFFFAOYSA-N
XLogP1.19
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-1-[3-(2-methylsulfanylethyl)imidazol-4-yl]propan-1-amine
CID 102969725
3-[5-(1-amino-2-methylpropyl)imidazol-1-yl]propanamide
CID 102969533
1-[3-(2-ethylbutyl)imidazol-4-yl]-2-methylpropan-1-amine
CID 102969891
2-methyl-1-[3-(5-methylsulfanylpentyl)imidazol-4-yl]propan-1-amine
CID 114128184
1-(2-methoxyethyl)-5-(2-methylpropyl)imidazole
CID 139364682
(1S)-1-[3-[2-[2-methoxyethyl(methyl)amino]ethyl]imidazol-4-yl]ethanamine
CID 104942948
2-amino-2-[3-[2-(2-methoxyethoxy)ethyl]imidazol-4-yl]ethanol
CID 114704613
2-methyl-1-[3-(2-thiomorpholin-4-ylethyl)imidazol-4-yl]propan-1-amine
CID 114174001
[3-(2-methoxyethyl)imidazol-4-yl]methanamine;dihydrochloride
CID 75530754
3-[5-(1-amino-2-methylpropyl)imidazol-1-yl]-N-ethylpropanamide
CID 102969836
2-[3-(2-methoxyethyl)imidazol-4-yl]ethanamine
CID 114717344
2-methyl-1-[3-[2-(4-nitrophenyl)ethyl]imidazol-4-yl]propan-1-amine
CID 102969562

Frequently Asked Questions

What is the IUPAC name of 1-[3-(2-methoxyethyl)imidazol-4-yl]-2-methylpropan-1-amine?
The IUPAC name of 1-[3-(2-methoxyethyl)imidazol-4-yl]-2-methylpropan-1-amine (CID 102969486) is 1-[3-(2-methoxyethyl)imidazol-4-yl]-2-methylpropan-1-amine.
What is the SMILES notation for 1-[3-(2-methoxyethyl)imidazol-4-yl]-2-methylpropan-1-amine?
The canonical SMILES for 1-[3-(2-methoxyethyl)imidazol-4-yl]-2-methylpropan-1-amine is COCCn1cncc1C(N)C(C)C.
What is the InChIKey of 1-[3-(2-methoxyethyl)imidazol-4-yl]-2-methylpropan-1-amine?
The InChIKey is ZULROTCSLFPAIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O/c1-8(2)10(11)9-6-12-7-13(9)4-5-14-3/h6-8,10H,4-5,11H2,1-3H3.
What are the key properties of 1-[3-(2-methoxyethyl)imidazol-4-yl]-2-methylpropan-1-amine?
1-[3-(2-methoxyethyl)imidazol-4-yl]-2-methylpropan-1-amine has a molecular weight of 197.28 g/mol, XLogP of 1.19, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(2-methoxyethyl)imidazol-4-yl]-2-methylpropan-1-amine is sourced from PubChem (CID 102969486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).