1-amino-N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-3-ethoxy-2,2-dimethylcyclobutane-1-carboxamide

C15H25N3O3 — CID 105055895

IUPAC1-amino-N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-3-ethoxy-2,2-dimethylcyclobutane-1-carboxamide
SMILESCCOC1CC(N)(C(=O)NCc2nc(C)c(C)o2)C1(C)C
InChIInChI=1S/C15H25N3O3/c1-6-20-11-7-15(16,14(11,4)5)13(19)17-8-12-18-9(2)10(3)21-12/h11H,6-8,16H2,1-5H3,(H,17,19)
InChIKeyLQLWLCCGGRUXEZ-UHFFFAOYSA-N
MW295.38 g/mol
LogP1.44
Rot. Bonds5

About 1-amino-N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-3-ethoxy-2,2-dimethylcyclobutane-1-carboxamide

1-amino-N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-3-ethoxy-2,2-dimethylcyclobutane-1-carboxamide (PubChem CID 105055895) has the molecular formula C15H25N3O3 and a molecular weight of 295.38 g/mol. Its IUPAC name is 1-amino-N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-3-ethoxy-2,2-dimethylcyclobutane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-3-ethoxy-2,2-dimethylcyclobutane-1-carboxamide
PubChem CID105055895
Molecular FormulaC15H25N3O3
Molecular Weight295.38 g/mol
Exact Mass295.19
IUPAC Name1-amino-N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-3-ethoxy-2,2-dimethylcyclobutane-1-carboxamide
SMILESCCOC1CC(N)(C(=O)NCc2nc(C)c(C)o2)C1(C)C
InChIInChI=1S/C15H25N3O3/c1-6-20-11-7-15(16,14(11,4)5)13(19)17-8-12-18-9(2)10(3)21-12/h11H,6-8,16H2,1-5H3,(H,17,19)
InChIKeyLQLWLCCGGRUXEZ-UHFFFAOYSA-N
XLogP1.44
TPSA90.38 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.38
LogP ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 1-amino-N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-3-ethoxy-2,2-dimethylcyclobutane-1-carboxamide with MolForge

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Related Compounds

1-amino-3-ethoxy-N-ethyl-2,2-dimethylcyclobutane-1-carboxamide
CID 114827765
1-amino-3-ethoxy-N-(2-methoxyethyl)-2,2-dimethylcyclobutane-1-carboxamide
CID 114827759
1-amino-3-ethoxy-2,2-dimethyl-N-(2-methylcyclopropyl)cyclobutane-1-carboxamide
CID 114829122
1-amino-3-ethoxy-2,2-dimethyl-N-(2,2,3,3-tetramethylcyclopropyl)cyclobutane-1-carboxamide
CID 114829539
1-amino-N-[(4-bromothiophen-2-yl)methyl]-3-ethoxy-2,2-dimethylcyclobutane-1-carboxamide
CID 114829337
1-amino-3-ethoxy-N-hydroxy-2,2-dimethylcyclobutane-1-carboxamide
CID 114829312
1-amino-N-(cyanomethyl)-3-ethoxy-2,2-dimethylcyclobutane-1-carboxamide
CID 114828942
1-amino-N-(4,6-dimethylpyrimidin-2-yl)-3-ethoxy-2,2-dimethylcyclobutane-1-carboxamide
CID 114827966
1-amino-3-ethoxy-N-[(3-ethylthiophen-2-yl)methyl]-2,2-dimethylcyclobutane-1-carboxamide
CID 114829608
1-amino-3-ethoxy-N-[2-(2-methoxyethoxy)ethyl]-2,2-dimethylcyclobutane-1-carboxamide
CID 114829054
1-amino-3-ethoxy-N-(4-hydroxybutyl)-2,2-dimethylcyclobutane-1-carboxamide
CID 106842172
1-amino-3-ethoxy-2,2-dimethyl-N-(2-methyl-2-methylsulfanylpropyl)cyclobutane-1-carboxamide
CID 114829969

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-3-ethoxy-2,2-dimethylcyclobutane-1-carboxamide?
The IUPAC name of 1-amino-N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-3-ethoxy-2,2-dimethylcyclobutane-1-carboxamide (CID 105055895) is 1-amino-N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-3-ethoxy-2,2-dimethylcyclobutane-1-carboxamide.
What is the SMILES notation for 1-amino-N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-3-ethoxy-2,2-dimethylcyclobutane-1-carboxamide?
The canonical SMILES for 1-amino-N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-3-ethoxy-2,2-dimethylcyclobutane-1-carboxamide is CCOC1CC(N)(C(=O)NCc2nc(C)c(C)o2)C1(C)C.
What is the InChIKey of 1-amino-N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-3-ethoxy-2,2-dimethylcyclobutane-1-carboxamide?
The InChIKey is LQLWLCCGGRUXEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O3/c1-6-20-11-7-15(16,14(11,4)5)13(19)17-8-12-18-9(2)10(3)21-12/h11H,6-8,16H2,1-5H3,(H,17,19).
What are the key properties of 1-amino-N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-3-ethoxy-2,2-dimethylcyclobutane-1-carboxamide?
1-amino-N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-3-ethoxy-2,2-dimethylcyclobutane-1-carboxamide has a molecular weight of 295.38 g/mol, XLogP of 1.44, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-3-ethoxy-2,2-dimethylcyclobutane-1-carboxamide is sourced from PubChem (CID 105055895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).