5-(4-methoxyphenyl)-5-methyl-1-propyl-4H-imidazol-2-amine

C14H21N3O — CID 79510183

IUPAC5-(4-methoxyphenyl)-5-methyl-1-propyl-4H-imidazol-2-amine
SMILESCCCN1C(N)=NCC1(C)c1ccc(OC)cc1
InChIInChI=1S/C14H21N3O/c1-4-9-17-13(15)16-10-14(17,2)11-5-7-12(18-3)8-6-11/h5-8H,4,9-10H2,1-3H3,(H2,15,16)
InChIKeyDKEIGYANUPWOQS-UHFFFAOYSA-N
MW247.34 g/mol
LogP1.95
Rot. Bonds4

About 5-(4-methoxyphenyl)-5-methyl-1-propyl-4H-imidazol-2-amine

5-(4-methoxyphenyl)-5-methyl-1-propyl-4H-imidazol-2-amine (PubChem CID 79510183) has the molecular formula C14H21N3O and a molecular weight of 247.34 g/mol. Its IUPAC name is 5-(4-methoxyphenyl)-5-methyl-1-propyl-4H-imidazol-2-amine.

Molecular Properties

Compound Name5-(4-methoxyphenyl)-5-methyl-1-propyl-4H-imidazol-2-amine
PubChem CID79510183
Molecular FormulaC14H21N3O
Molecular Weight247.34 g/mol
Exact Mass247.17
IUPAC Name5-(4-methoxyphenyl)-5-methyl-1-propyl-4H-imidazol-2-amine
SMILESCCCN1C(N)=NCC1(C)c1ccc(OC)cc1
InChIInChI=1S/C14H21N3O/c1-4-9-17-13(15)16-10-14(17,2)11-5-7-12(18-3)8-6-11/h5-8H,4,9-10H2,1-3H3,(H2,15,16)
InChIKeyDKEIGYANUPWOQS-UHFFFAOYSA-N
XLogP1.95
TPSA50.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(4-methoxyphenyl)-5-methyl-1-propyl-4H-imidazol-2-amine?
The IUPAC name of 5-(4-methoxyphenyl)-5-methyl-1-propyl-4H-imidazol-2-amine (CID 79510183) is 5-(4-methoxyphenyl)-5-methyl-1-propyl-4H-imidazol-2-amine.
What is the SMILES notation for 5-(4-methoxyphenyl)-5-methyl-1-propyl-4H-imidazol-2-amine?
The canonical SMILES for 5-(4-methoxyphenyl)-5-methyl-1-propyl-4H-imidazol-2-amine is CCCN1C(N)=NCC1(C)c1ccc(OC)cc1.
What is the InChIKey of 5-(4-methoxyphenyl)-5-methyl-1-propyl-4H-imidazol-2-amine?
The InChIKey is DKEIGYANUPWOQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O/c1-4-9-17-13(15)16-10-14(17,2)11-5-7-12(18-3)8-6-11/h5-8H,4,9-10H2,1-3H3,(H2,15,16).
What are the key properties of 5-(4-methoxyphenyl)-5-methyl-1-propyl-4H-imidazol-2-amine?
5-(4-methoxyphenyl)-5-methyl-1-propyl-4H-imidazol-2-amine has a molecular weight of 247.34 g/mol, XLogP of 1.95, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-methoxyphenyl)-5-methyl-1-propyl-4H-imidazol-2-amine is sourced from PubChem (CID 79510183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).