N-(2,5-difluoro-4-methylphenyl)-1-(2-methoxyethyl)imidazol-2-amine

C13H15F2N3O — CID 106583661

IUPACN-(2,5-difluoro-4-methylphenyl)-1-(2-methoxyethyl)imidazol-2-amine
SMILESCOCCn1ccnc1Nc1cc(F)c(C)cc1F
InChIInChI=1S/C13H15F2N3O/c1-9-7-11(15)12(8-10(9)14)17-13-16-3-4-18(13)5-6-19-2/h3-4,7-8H,5-6H2,1-2H3,(H,16,17)
InChIKeyIMVNNZHXOYLQKG-UHFFFAOYSA-N
MW267.28 g/mol
LogP2.86
Rot. Bonds5

About N-(2,5-difluoro-4-methylphenyl)-1-(2-methoxyethyl)imidazol-2-amine

N-(2,5-difluoro-4-methylphenyl)-1-(2-methoxyethyl)imidazol-2-amine (PubChem CID 106583661) has the molecular formula C13H15F2N3O and a molecular weight of 267.28 g/mol. Its IUPAC name is N-(2,5-difluoro-4-methylphenyl)-1-(2-methoxyethyl)imidazol-2-amine.

Molecular Properties

Compound NameN-(2,5-difluoro-4-methylphenyl)-1-(2-methoxyethyl)imidazol-2-amine
PubChem CID106583661
Molecular FormulaC13H15F2N3O
Molecular Weight267.28 g/mol
Exact Mass267.12
IUPAC NameN-(2,5-difluoro-4-methylphenyl)-1-(2-methoxyethyl)imidazol-2-amine
SMILESCOCCn1ccnc1Nc1cc(F)c(C)cc1F
InChIInChI=1S/C13H15F2N3O/c1-9-7-11(15)12(8-10(9)14)17-13-16-3-4-18(13)5-6-19-2/h3-4,7-8H,5-6H2,1-2H3,(H,16,17)
InChIKeyIMVNNZHXOYLQKG-UHFFFAOYSA-N
XLogP2.86
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.28
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-fluoro-4-methylphenyl)-1-(3-methoxypropyl)imidazol-2-amine
CID 106560415
1-(2-methoxyethyl)-N-(2,4,6-trimethylphenyl)imidazol-2-amine
CID 106555369
N-(2-bromo-5-chloro-4-methylphenyl)-1-(2-methoxyethyl)imidazol-2-amine
CID 106580696
N-(2-bromo-5-methylphenyl)-1-(2-methoxyethyl)imidazol-2-amine
CID 106578947
N-(2-chloro-4,6-difluorophenyl)-1-(2-methoxyethyl)imidazol-2-amine
CID 106578727
N-(4-bromo-3-methylphenyl)-1-(2-methoxyethyl)imidazol-2-amine
CID 106557048
N-[4-fluoro-3-(trifluoromethyl)phenyl]-1-(2-methoxyethyl)imidazol-2-amine
CID 106563769
N-(2-ethoxyphenyl)-1-(2-methoxyethyl)imidazol-2-amine
CID 106583771
N-(2-fluoro-6-methylphenyl)-1-(3-methoxypropyl)imidazol-2-amine
CID 106581649
N-(4-bromo-5-fluoro-2-methylphenyl)-1-(3-ethoxypropyl)imidazol-2-amine
CID 106582285
N-(4-bromo-2,5-difluorophenyl)-1-ethylimidazol-2-amine
CID 107608623
N-(3-chlorophenyl)-1-(2-methoxyethyl)imidazol-2-amine
CID 106558420

Frequently Asked Questions

What is the IUPAC name of N-(2,5-difluoro-4-methylphenyl)-1-(2-methoxyethyl)imidazol-2-amine?
The IUPAC name of N-(2,5-difluoro-4-methylphenyl)-1-(2-methoxyethyl)imidazol-2-amine (CID 106583661) is N-(2,5-difluoro-4-methylphenyl)-1-(2-methoxyethyl)imidazol-2-amine.
What is the SMILES notation for N-(2,5-difluoro-4-methylphenyl)-1-(2-methoxyethyl)imidazol-2-amine?
The canonical SMILES for N-(2,5-difluoro-4-methylphenyl)-1-(2-methoxyethyl)imidazol-2-amine is COCCn1ccnc1Nc1cc(F)c(C)cc1F.
What is the InChIKey of N-(2,5-difluoro-4-methylphenyl)-1-(2-methoxyethyl)imidazol-2-amine?
The InChIKey is IMVNNZHXOYLQKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15F2N3O/c1-9-7-11(15)12(8-10(9)14)17-13-16-3-4-18(13)5-6-19-2/h3-4,7-8H,5-6H2,1-2H3,(H,16,17).
What are the key properties of N-(2,5-difluoro-4-methylphenyl)-1-(2-methoxyethyl)imidazol-2-amine?
N-(2,5-difluoro-4-methylphenyl)-1-(2-methoxyethyl)imidazol-2-amine has a molecular weight of 267.28 g/mol, XLogP of 2.86, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-difluoro-4-methylphenyl)-1-(2-methoxyethyl)imidazol-2-amine is sourced from PubChem (CID 106583661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).