N-(2-ethoxypropyl)-1-(1-methoxypropan-2-yl)imidazol-2-amine

C12H23N3O2 — CID 106581219

IUPACN-(2-ethoxypropyl)-1-(1-methoxypropan-2-yl)imidazol-2-amine
SMILESCCOC(C)CNc1nccn1C(C)COC
InChIInChI=1S/C12H23N3O2/c1-5-17-11(3)8-14-12-13-6-7-15(12)10(2)9-16-4/h6-7,10-11H,5,8-9H2,1-4H3,(H,13,14)
InChIKeyAYSURQFACVIRGO-UHFFFAOYSA-N
MW241.33 g/mol
LogP1.93
Rot. Bonds8

About N-(2-ethoxypropyl)-1-(1-methoxypropan-2-yl)imidazol-2-amine

N-(2-ethoxypropyl)-1-(1-methoxypropan-2-yl)imidazol-2-amine (PubChem CID 106581219) has the molecular formula C12H23N3O2 and a molecular weight of 241.33 g/mol. Its IUPAC name is N-(2-ethoxypropyl)-1-(1-methoxypropan-2-yl)imidazol-2-amine.

Molecular Properties

Compound NameN-(2-ethoxypropyl)-1-(1-methoxypropan-2-yl)imidazol-2-amine
PubChem CID106581219
Molecular FormulaC12H23N3O2
Molecular Weight241.33 g/mol
Exact Mass241.18
IUPAC NameN-(2-ethoxypropyl)-1-(1-methoxypropan-2-yl)imidazol-2-amine
SMILESCCOC(C)CNc1nccn1C(C)COC
InChIInChI=1S/C12H23N3O2/c1-5-17-11(3)8-14-12-13-6-7-15(12)10(2)9-16-4/h6-7,10-11H,5,8-9H2,1-4H3,(H,13,14)
InChIKeyAYSURQFACVIRGO-UHFFFAOYSA-N
XLogP1.93
TPSA48.31 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxypropyl)-1-(1-methoxypropan-2-yl)imidazol-2-amine?
The IUPAC name of N-(2-ethoxypropyl)-1-(1-methoxypropan-2-yl)imidazol-2-amine (CID 106581219) is N-(2-ethoxypropyl)-1-(1-methoxypropan-2-yl)imidazol-2-amine.
What is the SMILES notation for N-(2-ethoxypropyl)-1-(1-methoxypropan-2-yl)imidazol-2-amine?
The canonical SMILES for N-(2-ethoxypropyl)-1-(1-methoxypropan-2-yl)imidazol-2-amine is CCOC(C)CNc1nccn1C(C)COC.
What is the InChIKey of N-(2-ethoxypropyl)-1-(1-methoxypropan-2-yl)imidazol-2-amine?
The InChIKey is AYSURQFACVIRGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O2/c1-5-17-11(3)8-14-12-13-6-7-15(12)10(2)9-16-4/h6-7,10-11H,5,8-9H2,1-4H3,(H,13,14).
What are the key properties of N-(2-ethoxypropyl)-1-(1-methoxypropan-2-yl)imidazol-2-amine?
N-(2-ethoxypropyl)-1-(1-methoxypropan-2-yl)imidazol-2-amine has a molecular weight of 241.33 g/mol, XLogP of 1.93, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxypropyl)-1-(1-methoxypropan-2-yl)imidazol-2-amine is sourced from PubChem (CID 106581219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).