5-tert-butyl-1-(2-methoxyphenyl)-4,5-dihydroimidazol-2-amine

C14H21N3O — CID 79514423

IUPAC5-tert-butyl-1-(2-methoxyphenyl)-4,5-dihydroimidazol-2-amine
SMILESCOc1ccccc1N1C(N)=NCC1C(C)(C)C
InChIInChI=1S/C14H21N3O/c1-14(2,3)12-9-16-13(15)17(12)10-7-5-6-8-11(10)18-4/h5-8,12H,9H2,1-4H3,(H2,15,16)
InChIKeyAUXDYWQXROJZJL-UHFFFAOYSA-N
MW247.34 g/mol
LogP2.24
Rot. Bonds2

About 5-tert-butyl-1-(2-methoxyphenyl)-4,5-dihydroimidazol-2-amine

5-tert-butyl-1-(2-methoxyphenyl)-4,5-dihydroimidazol-2-amine (PubChem CID 79514423) has the molecular formula C14H21N3O and a molecular weight of 247.34 g/mol. Its IUPAC name is 5-tert-butyl-1-(2-methoxyphenyl)-4,5-dihydroimidazol-2-amine.

Molecular Properties

Compound Name5-tert-butyl-1-(2-methoxyphenyl)-4,5-dihydroimidazol-2-amine
PubChem CID79514423
Molecular FormulaC14H21N3O
Molecular Weight247.34 g/mol
Exact Mass247.17
IUPAC Name5-tert-butyl-1-(2-methoxyphenyl)-4,5-dihydroimidazol-2-amine
SMILESCOc1ccccc1N1C(N)=NCC1C(C)(C)C
InChIInChI=1S/C14H21N3O/c1-14(2,3)12-9-16-13(15)17(12)10-7-5-6-8-11(10)18-4/h5-8,12H,9H2,1-4H3,(H2,15,16)
InChIKeyAUXDYWQXROJZJL-UHFFFAOYSA-N
XLogP2.24
TPSA50.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2-methoxyphenyl)-5-propyl-4,5-dihydroimidazol-2-amine
CID 79514424
5-(4-bromophenyl)-1-(2-methoxyphenyl)-4,5-dihydroimidazol-2-amine
CID 79501885
4-[2-amino-3-(2-methoxyphenyl)-4,5-dihydroimidazol-4-yl]phenol
CID 79501434
5-(2-methoxyphenyl)-1-methyl-5,6-dihydro-4H-pyrimidin-2-amine
CID 70508569
5-methyl-1-(2-methylphenyl)-4,5-dihydroimidazol-2-amine
CID 79505477
1-butan-2-yl-5-(2-methoxyphenyl)-4,5-dihydroimidazol-2-amine
CID 79514508
1-(2-fluorophenyl)-5-(4-methoxyphenyl)-4,5-dihydroimidazol-2-amine
CID 79500811
5-(4-methoxy-3-methylphenyl)-1-phenyl-4,5-dihydroimidazol-2-amine
CID 79500733
5-bromo-1-(2-methoxyphenyl)imidazol-2-amine
CID 172993232
4-(2-methoxyphenyl)-2-methyl-2,3-dihydro-1,4-benzoxazine
CID 117007415
1-(2-methoxyphenyl)-N,N-dimethylazetidin-3-amine
CID 175916234
3-(2-methoxyphenyl)-3-azabicyclo[3.1.0]hexan-6-amine
CID 115004150

Frequently Asked Questions

What is the IUPAC name of 5-tert-butyl-1-(2-methoxyphenyl)-4,5-dihydroimidazol-2-amine?
The IUPAC name of 5-tert-butyl-1-(2-methoxyphenyl)-4,5-dihydroimidazol-2-amine (CID 79514423) is 5-tert-butyl-1-(2-methoxyphenyl)-4,5-dihydroimidazol-2-amine.
What is the SMILES notation for 5-tert-butyl-1-(2-methoxyphenyl)-4,5-dihydroimidazol-2-amine?
The canonical SMILES for 5-tert-butyl-1-(2-methoxyphenyl)-4,5-dihydroimidazol-2-amine is COc1ccccc1N1C(N)=NCC1C(C)(C)C.
What is the InChIKey of 5-tert-butyl-1-(2-methoxyphenyl)-4,5-dihydroimidazol-2-amine?
The InChIKey is AUXDYWQXROJZJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O/c1-14(2,3)12-9-16-13(15)17(12)10-7-5-6-8-11(10)18-4/h5-8,12H,9H2,1-4H3,(H2,15,16).
What are the key properties of 5-tert-butyl-1-(2-methoxyphenyl)-4,5-dihydroimidazol-2-amine?
5-tert-butyl-1-(2-methoxyphenyl)-4,5-dihydroimidazol-2-amine has a molecular weight of 247.34 g/mol, XLogP of 2.24, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-tert-butyl-1-(2-methoxyphenyl)-4,5-dihydroimidazol-2-amine is sourced from PubChem (CID 79514423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).