3-cyclopropyl-5-(4-propan-2-yloxyphenyl)imidazol-4-amine

C15H19N3O — CID 62017174

IUPAC3-cyclopropyl-5-(4-propan-2-yloxyphenyl)imidazol-4-amine
SMILESCC(C)Oc1ccc(-c2ncn(C3CC3)c2N)cc1
InChIInChI=1S/C15H19N3O/c1-10(2)19-13-7-3-11(4-8-13)14-15(16)18(9-17-14)12-5-6-12/h3-4,7-10,12H,5-6,16H2,1-2H3
InChIKeyMRHILAPVLDXOBZ-UHFFFAOYSA-N
MW257.34 g/mol
LogP3.25
Rot. Bonds4

About 3-cyclopropyl-5-(4-propan-2-yloxyphenyl)imidazol-4-amine

3-cyclopropyl-5-(4-propan-2-yloxyphenyl)imidazol-4-amine (PubChem CID 62017174) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is 3-cyclopropyl-5-(4-propan-2-yloxyphenyl)imidazol-4-amine.

Molecular Properties

Compound Name3-cyclopropyl-5-(4-propan-2-yloxyphenyl)imidazol-4-amine
PubChem CID62017174
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC Name3-cyclopropyl-5-(4-propan-2-yloxyphenyl)imidazol-4-amine
SMILESCC(C)Oc1ccc(-c2ncn(C3CC3)c2N)cc1
InChIInChI=1S/C15H19N3O/c1-10(2)19-13-7-3-11(4-8-13)14-15(16)18(9-17-14)12-5-6-12/h3-4,7-10,12H,5-6,16H2,1-2H3
InChIKeyMRHILAPVLDXOBZ-UHFFFAOYSA-N
XLogP3.25
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-5-(4-propan-2-yloxyphenyl)imidazol-4-amine?
The IUPAC name of 3-cyclopropyl-5-(4-propan-2-yloxyphenyl)imidazol-4-amine (CID 62017174) is 3-cyclopropyl-5-(4-propan-2-yloxyphenyl)imidazol-4-amine.
What is the SMILES notation for 3-cyclopropyl-5-(4-propan-2-yloxyphenyl)imidazol-4-amine?
The canonical SMILES for 3-cyclopropyl-5-(4-propan-2-yloxyphenyl)imidazol-4-amine is CC(C)Oc1ccc(-c2ncn(C3CC3)c2N)cc1.
What is the InChIKey of 3-cyclopropyl-5-(4-propan-2-yloxyphenyl)imidazol-4-amine?
The InChIKey is MRHILAPVLDXOBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-10(2)19-13-7-3-11(4-8-13)14-15(16)18(9-17-14)12-5-6-12/h3-4,7-10,12H,5-6,16H2,1-2H3.
What are the key properties of 3-cyclopropyl-5-(4-propan-2-yloxyphenyl)imidazol-4-amine?
3-cyclopropyl-5-(4-propan-2-yloxyphenyl)imidazol-4-amine has a molecular weight of 257.34 g/mol, XLogP of 3.25, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-5-(4-propan-2-yloxyphenyl)imidazol-4-amine is sourced from PubChem (CID 62017174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).