1-(2-methoxybutyl)imidazol-2-amine

C8H15N3O — CID 165482307

IUPAC1-(2-methoxybutyl)imidazol-2-amine
SMILESCCC(Cn1ccnc1N)OC
InChIInChI=1S/C8H15N3O/c1-3-7(12-2)6-11-5-4-10-8(11)9/h4-5,7H,3,6H2,1-2H3,(H2,9,10)
InChIKeyXRFDIAFEIJUEMM-UHFFFAOYSA-N
MW169.23 g/mol
LogP0.89
Rot. Bonds4

About 1-(2-methoxybutyl)imidazol-2-amine

1-(2-methoxybutyl)imidazol-2-amine (PubChem CID 165482307) has the molecular formula C8H15N3O and a molecular weight of 169.23 g/mol. Its IUPAC name is 1-(2-methoxybutyl)imidazol-2-amine.

Molecular Properties

Compound Name1-(2-methoxybutyl)imidazol-2-amine
PubChem CID165482307
Molecular FormulaC8H15N3O
Molecular Weight169.23 g/mol
Exact Mass169.12
IUPAC Name1-(2-methoxybutyl)imidazol-2-amine
SMILESCCC(Cn1ccnc1N)OC
InChIInChI=1S/C8H15N3O/c1-3-7(12-2)6-11-5-4-10-8(11)9/h4-5,7H,3,6H2,1-2H3,(H2,9,10)
InChIKeyXRFDIAFEIJUEMM-UHFFFAOYSA-N
XLogP0.89
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.23
LogP ≤ 50.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2-methoxybutyl)pyrazol-3-amine
CID 165472037
1-(2-methylsulfinylpropyl)imidazol-2-amine
CID 106581041
1-butylimidazol-2-amine
CID 60860613
1-pentylimidazol-2-amine
CID 61354351
1-(2-aminoimidazol-1-yl)-2-methylpropan-2-ol
CID 165463249
1-[(E)-but-2-enyl]imidazol-2-amine
CID 131607120
1-[3-[ethyl(methyl)amino]-2-methoxypropyl]-N-propan-2-ylimidazol-2-amine
CID 106582025
methyl 3-(2-aminoimidazol-1-yl)-2,2-dimethylpropanoate
CID 165473447
2-(2-methoxypropyl)-1-(2-methylpropyl)imidazole
CID 54499010
2-bromo-1-(2-methylpropyl)imidazole
CID 58719811
1-[2-(2-methoxyethylsulfonyl)ethyl]imidazol-2-amine
CID 165473501
4-amino-3-methoxy-N-[1-(2-methylpropyl)imidazol-2-yl]butanamide;hydrochloride
CID 120590996

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxybutyl)imidazol-2-amine?
The IUPAC name of 1-(2-methoxybutyl)imidazol-2-amine (CID 165482307) is 1-(2-methoxybutyl)imidazol-2-amine.
What is the SMILES notation for 1-(2-methoxybutyl)imidazol-2-amine?
The canonical SMILES for 1-(2-methoxybutyl)imidazol-2-amine is CCC(Cn1ccnc1N)OC.
What is the InChIKey of 1-(2-methoxybutyl)imidazol-2-amine?
The InChIKey is XRFDIAFEIJUEMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3O/c1-3-7(12-2)6-11-5-4-10-8(11)9/h4-5,7H,3,6H2,1-2H3,(H2,9,10).
What are the key properties of 1-(2-methoxybutyl)imidazol-2-amine?
1-(2-methoxybutyl)imidazol-2-amine has a molecular weight of 169.23 g/mol, XLogP of 0.89, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxybutyl)imidazol-2-amine is sourced from PubChem (CID 165482307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).