3,5-dimethyl-N-(1,2-oxazol-3-yl)adamantane-1-carboxamide

C16H22N2O2 — CID 6469518

IUPAC3,5-dimethyl-N-(1,2-oxazol-3-yl)adamantane-1-carboxamide
SMILESCC12CC3CC(C)(C1)CC(C(=O)Nc1ccon1)(C3)C2
InChIInChI=1S/C16H22N2O2/c1-14-5-11-6-15(2,8-14)10-16(7-11,9-14)13(19)17-12-3-4-20-18-12/h3-4,11H,5-10H2,1-2H3,(H,17,18,19)
InChIKeyDPSKPDWNYGBYAE-UHFFFAOYSA-N
MW274.36 g/mol
LogP3.61
Rot. Bonds2

About 3,5-dimethyl-N-(1,2-oxazol-3-yl)adamantane-1-carboxamide

3,5-dimethyl-N-(1,2-oxazol-3-yl)adamantane-1-carboxamide (PubChem CID 6469518) has the molecular formula C16H22N2O2 and a molecular weight of 274.36 g/mol. Its IUPAC name is 3,5-dimethyl-N-(1,2-oxazol-3-yl)adamantane-1-carboxamide.

Molecular Properties

Compound Name3,5-dimethyl-N-(1,2-oxazol-3-yl)adamantane-1-carboxamide
PubChem CID6469518
Molecular FormulaC16H22N2O2
Molecular Weight274.36 g/mol
Exact Mass274.17
IUPAC Name3,5-dimethyl-N-(1,2-oxazol-3-yl)adamantane-1-carboxamide
SMILESCC12CC3CC(C)(C1)CC(C(=O)Nc1ccon1)(C3)C2
InChIInChI=1S/C16H22N2O2/c1-14-5-11-6-15(2,8-14)10-16(7-11,9-14)13(19)17-12-3-4-20-18-12/h3-4,11H,5-10H2,1-2H3,(H,17,18,19)
InChIKeyDPSKPDWNYGBYAE-UHFFFAOYSA-N
XLogP3.61
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.36
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3,5-dimethyl-N-(1,2-oxazol-3-yl)adamantane-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethyl-N-(1,2-oxazol-3-yl)adamantane-1-carboxamide?
The IUPAC name of 3,5-dimethyl-N-(1,2-oxazol-3-yl)adamantane-1-carboxamide (CID 6469518) is 3,5-dimethyl-N-(1,2-oxazol-3-yl)adamantane-1-carboxamide.
What is the SMILES notation for 3,5-dimethyl-N-(1,2-oxazol-3-yl)adamantane-1-carboxamide?
The canonical SMILES for 3,5-dimethyl-N-(1,2-oxazol-3-yl)adamantane-1-carboxamide is CC12CC3CC(C)(C1)CC(C(=O)Nc1ccon1)(C3)C2.
What is the InChIKey of 3,5-dimethyl-N-(1,2-oxazol-3-yl)adamantane-1-carboxamide?
The InChIKey is DPSKPDWNYGBYAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O2/c1-14-5-11-6-15(2,8-14)10-16(7-11,9-14)13(19)17-12-3-4-20-18-12/h3-4,11H,5-10H2,1-2H3,(H,17,18,19).
What are the key properties of 3,5-dimethyl-N-(1,2-oxazol-3-yl)adamantane-1-carboxamide?
3,5-dimethyl-N-(1,2-oxazol-3-yl)adamantane-1-carboxamide has a molecular weight of 274.36 g/mol, XLogP of 3.61, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethyl-N-(1,2-oxazol-3-yl)adamantane-1-carboxamide is sourced from PubChem (CID 6469518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).