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

C12H23N3O — CID 106561717

IUPAC1-(2-methoxyethyl)-N-(4-methylpentan-2-yl)imidazol-2-amine
SMILESCOCCn1ccnc1NC(C)CC(C)C
InChIInChI=1S/C12H23N3O/c1-10(2)9-11(3)14-12-13-5-6-15(12)7-8-16-4/h5-6,10-11H,7-9H2,1-4H3,(H,13,14)
InChIKeyXJFDFCHFRSRZEP-UHFFFAOYSA-N
MW225.34 g/mol
LogP2.38
Rot. Bonds7

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

1-(2-methoxyethyl)-N-(4-methylpentan-2-yl)imidazol-2-amine (PubChem CID 106561717) has the molecular formula C12H23N3O and a molecular weight of 225.34 g/mol. Its IUPAC name is 1-(2-methoxyethyl)-N-(4-methylpentan-2-yl)imidazol-2-amine.

Molecular Properties

Compound Name1-(2-methoxyethyl)-N-(4-methylpentan-2-yl)imidazol-2-amine
PubChem CID106561717
Molecular FormulaC12H23N3O
Molecular Weight225.34 g/mol
Exact Mass225.18
IUPAC Name1-(2-methoxyethyl)-N-(4-methylpentan-2-yl)imidazol-2-amine
SMILESCOCCn1ccnc1NC(C)CC(C)C
InChIInChI=1S/C12H23N3O/c1-10(2)9-11(3)14-12-13-5-6-15(12)7-8-16-4/h5-6,10-11H,7-9H2,1-4H3,(H,13,14)
InChIKeyXJFDFCHFRSRZEP-UHFFFAOYSA-N
XLogP2.38
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.34
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2-methoxyethyl)-N-(4-methylhexan-2-yl)imidazol-2-amine
CID 106574023
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-methoxypropan-2-yl)-1-(3-pyrrolidin-1-ylpropyl)imidazol-2-amine
CID 106572044
N-(1-ethoxypropan-2-yl)-1-propylimidazol-2-amine
CID 106565346
1-(2-methoxyethyl)-N-(2-propan-2-ylcyclohexyl)imidazol-2-amine
CID 106579261
1-(2-methoxyethyl)-N-(4-methylpentan-2-yl)pyrazol-4-amine
CID 43729075
N-(1-methoxypropan-2-yl)-1-[2-(3-methylcyclohexyl)ethyl]imidazol-2-amine
CID 106574347
1-(2-methoxyethyl)-N-(2,4,6-trimethylphenyl)imidazol-2-amine
CID 106555369

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethyl)-N-(4-methylpentan-2-yl)imidazol-2-amine?
The IUPAC name of 1-(2-methoxyethyl)-N-(4-methylpentan-2-yl)imidazol-2-amine (CID 106561717) is 1-(2-methoxyethyl)-N-(4-methylpentan-2-yl)imidazol-2-amine.
What is the SMILES notation for 1-(2-methoxyethyl)-N-(4-methylpentan-2-yl)imidazol-2-amine?
The canonical SMILES for 1-(2-methoxyethyl)-N-(4-methylpentan-2-yl)imidazol-2-amine is COCCn1ccnc1NC(C)CC(C)C.
What is the InChIKey of 1-(2-methoxyethyl)-N-(4-methylpentan-2-yl)imidazol-2-amine?
The InChIKey is XJFDFCHFRSRZEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O/c1-10(2)9-11(3)14-12-13-5-6-15(12)7-8-16-4/h5-6,10-11H,7-9H2,1-4H3,(H,13,14).
What are the key properties of 1-(2-methoxyethyl)-N-(4-methylpentan-2-yl)imidazol-2-amine?
1-(2-methoxyethyl)-N-(4-methylpentan-2-yl)imidazol-2-amine has a molecular weight of 225.34 g/mol, XLogP of 2.38, 7 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-methylpentan-2-yl)imidazol-2-amine is sourced from PubChem (CID 106561717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).