N-methyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]-2-(3-oxo-2-azaspiro[4.5]decan-2-yl)acetamide

C17H25N3O3 — CID 72911343

IUPACN-methyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]-2-(3-oxo-2-azaspiro[4.5]decan-2-yl)acetamide
SMILESCc1cc(CN(C)C(=O)CN2CC3(CCCCC3)CC2=O)on1
InChIInChI=1S/C17H25N3O3/c1-13-8-14(23-18-13)10-19(2)16(22)11-20-12-17(9-15(20)21)6-4-3-5-7-17/h8H,3-7,9-12H2,1-2H3
InChIKeyIIKOEWYHEFHDNP-UHFFFAOYSA-N
MW319.40 g/mol
LogP2.12
Rot. Bonds4

About N-methyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]-2-(3-oxo-2-azaspiro[4.5]decan-2-yl)acetamide

N-methyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]-2-(3-oxo-2-azaspiro[4.5]decan-2-yl)acetamide (PubChem CID 72911343) has the molecular formula C17H25N3O3 and a molecular weight of 319.40 g/mol. Its IUPAC name is N-methyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]-2-(3-oxo-2-azaspiro[4.5]decan-2-yl)acetamide.

Molecular Properties

Compound NameN-methyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]-2-(3-oxo-2-azaspiro[4.5]decan-2-yl)acetamide
PubChem CID72911343
Molecular FormulaC17H25N3O3
Molecular Weight319.40 g/mol
Exact Mass319.19
IUPAC NameN-methyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]-2-(3-oxo-2-azaspiro[4.5]decan-2-yl)acetamide
SMILESCc1cc(CN(C)C(=O)CN2CC3(CCCCC3)CC2=O)on1
InChIInChI=1S/C17H25N3O3/c1-13-8-14(23-18-13)10-19(2)16(22)11-20-12-17(9-15(20)21)6-4-3-5-7-17/h8H,3-7,9-12H2,1-2H3
InChIKeyIIKOEWYHEFHDNP-UHFFFAOYSA-N
XLogP2.12
TPSA66.65 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.40
LogP ≤ 52.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]-2-(3-oxo-2-azaspiro[4.5]decan-2-yl)acetamide?
The IUPAC name of N-methyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]-2-(3-oxo-2-azaspiro[4.5]decan-2-yl)acetamide (CID 72911343) is N-methyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]-2-(3-oxo-2-azaspiro[4.5]decan-2-yl)acetamide.
What is the SMILES notation for N-methyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]-2-(3-oxo-2-azaspiro[4.5]decan-2-yl)acetamide?
The canonical SMILES for N-methyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]-2-(3-oxo-2-azaspiro[4.5]decan-2-yl)acetamide is Cc1cc(CN(C)C(=O)CN2CC3(CCCCC3)CC2=O)on1.
What is the InChIKey of N-methyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]-2-(3-oxo-2-azaspiro[4.5]decan-2-yl)acetamide?
The InChIKey is IIKOEWYHEFHDNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O3/c1-13-8-14(23-18-13)10-19(2)16(22)11-20-12-17(9-15(20)21)6-4-3-5-7-17/h8H,3-7,9-12H2,1-2H3.
What are the key properties of N-methyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]-2-(3-oxo-2-azaspiro[4.5]decan-2-yl)acetamide?
N-methyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]-2-(3-oxo-2-azaspiro[4.5]decan-2-yl)acetamide has a molecular weight of 319.40 g/mol, XLogP of 2.12, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]-2-(3-oxo-2-azaspiro[4.5]decan-2-yl)acetamide is sourced from PubChem (CID 72911343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).