5-[2-(methoxymethyl)phenyl]-4,5-dihydro-1H-imidazol-2-amine

C11H15N3O — CID 79509782

IUPAC5-[2-(methoxymethyl)phenyl]-4,5-dihydro-1H-imidazol-2-amine
SMILESCOCc1ccccc1C1CN=C(N)N1
InChIInChI=1S/C11H15N3O/c1-15-7-8-4-2-3-5-9(8)10-6-13-11(12)14-10/h2-5,10H,6-7H2,1H3,(H3,12,13,14)
InChIKeyHAFYSPRBCHQZCM-UHFFFAOYSA-N
MW205.26 g/mol
LogP0.79
Rot. Bonds3

About 5-[2-(methoxymethyl)phenyl]-4,5-dihydro-1H-imidazol-2-amine

5-[2-(methoxymethyl)phenyl]-4,5-dihydro-1H-imidazol-2-amine (PubChem CID 79509782) has the molecular formula C11H15N3O and a molecular weight of 205.26 g/mol. Its IUPAC name is 5-[2-(methoxymethyl)phenyl]-4,5-dihydro-1H-imidazol-2-amine.

Molecular Properties

Compound Name5-[2-(methoxymethyl)phenyl]-4,5-dihydro-1H-imidazol-2-amine
PubChem CID79509782
Molecular FormulaC11H15N3O
Molecular Weight205.26 g/mol
Exact Mass205.12
IUPAC Name5-[2-(methoxymethyl)phenyl]-4,5-dihydro-1H-imidazol-2-amine
SMILESCOCc1ccccc1C1CN=C(N)N1
InChIInChI=1S/C11H15N3O/c1-15-7-8-4-2-3-5-9(8)10-6-13-11(12)14-10/h2-5,10H,6-7H2,1H3,(H3,12,13,14)
InChIKeyHAFYSPRBCHQZCM-UHFFFAOYSA-N
XLogP0.79
TPSA59.64 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 50.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-[2-(methoxymethyl)phenyl]-4,5-dihydro-1H-imidazol-2-amine?
The IUPAC name of 5-[2-(methoxymethyl)phenyl]-4,5-dihydro-1H-imidazol-2-amine (CID 79509782) is 5-[2-(methoxymethyl)phenyl]-4,5-dihydro-1H-imidazol-2-amine.
What is the SMILES notation for 5-[2-(methoxymethyl)phenyl]-4,5-dihydro-1H-imidazol-2-amine?
The canonical SMILES for 5-[2-(methoxymethyl)phenyl]-4,5-dihydro-1H-imidazol-2-amine is COCc1ccccc1C1CN=C(N)N1.
What is the InChIKey of 5-[2-(methoxymethyl)phenyl]-4,5-dihydro-1H-imidazol-2-amine?
The InChIKey is HAFYSPRBCHQZCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O/c1-15-7-8-4-2-3-5-9(8)10-6-13-11(12)14-10/h2-5,10H,6-7H2,1H3,(H3,12,13,14).
What are the key properties of 5-[2-(methoxymethyl)phenyl]-4,5-dihydro-1H-imidazol-2-amine?
5-[2-(methoxymethyl)phenyl]-4,5-dihydro-1H-imidazol-2-amine has a molecular weight of 205.26 g/mol, XLogP of 0.79, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(methoxymethyl)phenyl]-4,5-dihydro-1H-imidazol-2-amine is sourced from PubChem (CID 79509782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).