N-(1-cyclobutylimidazol-4-yl)-2-phenylacetamide

C15H17N3O — CID 45485623

IUPACN-(1-cyclobutylimidazol-4-yl)-2-phenylacetamide
SMILESO=C(Cc1ccccc1)Nc1cn(C2CCC2)cn1
InChIInChI=1S/C15H17N3O/c19-15(9-12-5-2-1-3-6-12)17-14-10-18(11-16-14)13-7-4-8-13/h1-3,5-6,10-11,13H,4,7-9H2,(H,17,19)
InChIKeyAUBBSDZYWJYPEN-UHFFFAOYSA-N
MW255.32 g/mol
LogP2.79
Rot. Bonds4

About N-(1-cyclobutylimidazol-4-yl)-2-phenylacetamide

N-(1-cyclobutylimidazol-4-yl)-2-phenylacetamide (PubChem CID 45485623) has the molecular formula C15H17N3O and a molecular weight of 255.32 g/mol. Its IUPAC name is N-(1-cyclobutylimidazol-4-yl)-2-phenylacetamide.

Molecular Properties

Compound NameN-(1-cyclobutylimidazol-4-yl)-2-phenylacetamide
PubChem CID45485623
Molecular FormulaC15H17N3O
Molecular Weight255.32 g/mol
Exact Mass255.14
IUPAC NameN-(1-cyclobutylimidazol-4-yl)-2-phenylacetamide
SMILESO=C(Cc1ccccc1)Nc1cn(C2CCC2)cn1
InChIInChI=1S/C15H17N3O/c19-15(9-12-5-2-1-3-6-12)17-14-10-18(11-16-14)13-7-4-8-13/h1-3,5-6,10-11,13H,4,7-9H2,(H,17,19)
InChIKeyAUBBSDZYWJYPEN-UHFFFAOYSA-N
XLogP2.79
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-cyclobutylimidazol-4-yl)-2-phenylacetamide?
The IUPAC name of N-(1-cyclobutylimidazol-4-yl)-2-phenylacetamide (CID 45485623) is N-(1-cyclobutylimidazol-4-yl)-2-phenylacetamide.
What is the SMILES notation for N-(1-cyclobutylimidazol-4-yl)-2-phenylacetamide?
The canonical SMILES for N-(1-cyclobutylimidazol-4-yl)-2-phenylacetamide is O=C(Cc1ccccc1)Nc1cn(C2CCC2)cn1.
What is the InChIKey of N-(1-cyclobutylimidazol-4-yl)-2-phenylacetamide?
The InChIKey is AUBBSDZYWJYPEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O/c19-15(9-12-5-2-1-3-6-12)17-14-10-18(11-16-14)13-7-4-8-13/h1-3,5-6,10-11,13H,4,7-9H2,(H,17,19).
What are the key properties of N-(1-cyclobutylimidazol-4-yl)-2-phenylacetamide?
N-(1-cyclobutylimidazol-4-yl)-2-phenylacetamide has a molecular weight of 255.32 g/mol, XLogP of 2.79, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclobutylimidazol-4-yl)-2-phenylacetamide is sourced from PubChem (CID 45485623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).