N-(5-methyl-1,2-oxazol-3-yl)-3-phenylcyclobutane-1-carboxamide

C15H16N2O2 — CID 154775274

IUPACN-(5-methyl-1,2-oxazol-3-yl)-3-phenylcyclobutane-1-carboxamide
SMILESCc1cc(NC(=O)C2CC(c3ccccc3)C2)no1
InChIInChI=1S/C15H16N2O2/c1-10-7-14(17-19-10)16-15(18)13-8-12(9-13)11-5-3-2-4-6-11/h2-7,12-13H,8-9H2,1H3,(H,16,17,18)
InChIKeyAMMIDQGXCXHNCB-UHFFFAOYSA-N
MW256.31 g/mol
LogP3.12
Rot. Bonds3

About N-(5-methyl-1,2-oxazol-3-yl)-3-phenylcyclobutane-1-carboxamide

N-(5-methyl-1,2-oxazol-3-yl)-3-phenylcyclobutane-1-carboxamide (PubChem CID 154775274) has the molecular formula C15H16N2O2 and a molecular weight of 256.31 g/mol. Its IUPAC name is N-(5-methyl-1,2-oxazol-3-yl)-3-phenylcyclobutane-1-carboxamide.

Molecular Properties

Compound NameN-(5-methyl-1,2-oxazol-3-yl)-3-phenylcyclobutane-1-carboxamide
PubChem CID154775274
Molecular FormulaC15H16N2O2
Molecular Weight256.31 g/mol
Exact Mass256.12
IUPAC NameN-(5-methyl-1,2-oxazol-3-yl)-3-phenylcyclobutane-1-carboxamide
SMILESCc1cc(NC(=O)C2CC(c3ccccc3)C2)no1
InChIInChI=1S/C15H16N2O2/c1-10-7-14(17-19-10)16-15(18)13-8-12(9-13)11-5-3-2-4-6-11/h2-7,12-13H,8-9H2,1H3,(H,16,17,18)
InChIKeyAMMIDQGXCXHNCB-UHFFFAOYSA-N
XLogP3.12
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(5-methyl-1,2-oxazol-3-yl)-3-phenylcyclobutane-1-carboxamide?
The IUPAC name of N-(5-methyl-1,2-oxazol-3-yl)-3-phenylcyclobutane-1-carboxamide (CID 154775274) is N-(5-methyl-1,2-oxazol-3-yl)-3-phenylcyclobutane-1-carboxamide.
What is the SMILES notation for N-(5-methyl-1,2-oxazol-3-yl)-3-phenylcyclobutane-1-carboxamide?
The canonical SMILES for N-(5-methyl-1,2-oxazol-3-yl)-3-phenylcyclobutane-1-carboxamide is Cc1cc(NC(=O)C2CC(c3ccccc3)C2)no1.
What is the InChIKey of N-(5-methyl-1,2-oxazol-3-yl)-3-phenylcyclobutane-1-carboxamide?
The InChIKey is AMMIDQGXCXHNCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2/c1-10-7-14(17-19-10)16-15(18)13-8-12(9-13)11-5-3-2-4-6-11/h2-7,12-13H,8-9H2,1H3,(H,16,17,18).
What are the key properties of N-(5-methyl-1,2-oxazol-3-yl)-3-phenylcyclobutane-1-carboxamide?
N-(5-methyl-1,2-oxazol-3-yl)-3-phenylcyclobutane-1-carboxamide has a molecular weight of 256.31 g/mol, XLogP of 3.12, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-1,2-oxazol-3-yl)-3-phenylcyclobutane-1-carboxamide is sourced from PubChem (CID 154775274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).