N-cyclohexyl-N,5-dimethyl-1,2-oxazole-3-carboxamide

C12H18N2O2 — CID 2814457

IUPACN-cyclohexyl-N,5-dimethyl-1,2-oxazole-3-carboxamide
SMILESCc1cc(C(=O)N(C)C2CCCCC2)no1
InChIInChI=1S/C12H18N2O2/c1-9-8-11(13-16-9)12(15)14(2)10-6-4-3-5-7-10/h8,10H,3-7H2,1-2H3
InChIKeyLVFOAWVOZPHELK-UHFFFAOYSA-N
MW222.29 g/mol
LogP2.39
Rot. Bonds2

About N-cyclohexyl-N,5-dimethyl-1,2-oxazole-3-carboxamide

N-cyclohexyl-N,5-dimethyl-1,2-oxazole-3-carboxamide (PubChem CID 2814457) has the molecular formula C12H18N2O2 and a molecular weight of 222.29 g/mol. Its IUPAC name is N-cyclohexyl-N,5-dimethyl-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-N,5-dimethyl-1,2-oxazole-3-carboxamide
PubChem CID2814457
Molecular FormulaC12H18N2O2
Molecular Weight222.29 g/mol
Exact Mass222.14
IUPAC NameN-cyclohexyl-N,5-dimethyl-1,2-oxazole-3-carboxamide
SMILESCc1cc(C(=O)N(C)C2CCCCC2)no1
InChIInChI=1S/C12H18N2O2/c1-9-8-11(13-16-9)12(15)14(2)10-6-4-3-5-7-10/h8,10H,3-7H2,1-2H3
InChIKeyLVFOAWVOZPHELK-UHFFFAOYSA-N
XLogP2.39
TPSA46.34 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 52.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N,5-dimethyl-1,2-oxazole-3-carboxamide?
The IUPAC name of N-cyclohexyl-N,5-dimethyl-1,2-oxazole-3-carboxamide (CID 2814457) is N-cyclohexyl-N,5-dimethyl-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-cyclohexyl-N,5-dimethyl-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-cyclohexyl-N,5-dimethyl-1,2-oxazole-3-carboxamide is Cc1cc(C(=O)N(C)C2CCCCC2)no1.
What is the InChIKey of N-cyclohexyl-N,5-dimethyl-1,2-oxazole-3-carboxamide?
The InChIKey is LVFOAWVOZPHELK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2/c1-9-8-11(13-16-9)12(15)14(2)10-6-4-3-5-7-10/h8,10H,3-7H2,1-2H3.
What are the key properties of N-cyclohexyl-N,5-dimethyl-1,2-oxazole-3-carboxamide?
N-cyclohexyl-N,5-dimethyl-1,2-oxazole-3-carboxamide has a molecular weight of 222.29 g/mol, XLogP of 2.39, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N,5-dimethyl-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 2814457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).