N-cyclopentyl-4,5-dimethyl-1,2-oxazole-3-carboxamide

C11H16N2O2 — CID 19589831

IUPACN-cyclopentyl-4,5-dimethyl-1,2-oxazole-3-carboxamide
SMILESCc1onc(C(=O)NC2CCCC2)c1C
InChIInChI=1S/C11H16N2O2/c1-7-8(2)15-13-10(7)11(14)12-9-5-3-4-6-9/h9H,3-6H2,1-2H3,(H,12,14)
InChIKeyHJCYGKSXQDUUPJ-UHFFFAOYSA-N
MW208.26 g/mol
LogP1.96
Rot. Bonds2

About N-cyclopentyl-4,5-dimethyl-1,2-oxazole-3-carboxamide

N-cyclopentyl-4,5-dimethyl-1,2-oxazole-3-carboxamide (PubChem CID 19589831) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is N-cyclopentyl-4,5-dimethyl-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-4,5-dimethyl-1,2-oxazole-3-carboxamide
PubChem CID19589831
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC NameN-cyclopentyl-4,5-dimethyl-1,2-oxazole-3-carboxamide
SMILESCc1onc(C(=O)NC2CCCC2)c1C
InChIInChI=1S/C11H16N2O2/c1-7-8(2)15-13-10(7)11(14)12-9-5-3-4-6-9/h9H,3-6H2,1-2H3,(H,12,14)
InChIKeyHJCYGKSXQDUUPJ-UHFFFAOYSA-N
XLogP1.96
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-methyl-N-[3-(2-oxo-1-pyrrolidinyl)propyl]-3-isoxazolecarboxamide
CID 2225426
N-cyclopentyl-5-isopropyl-4-nitroisoxazole-3-carboxamide
CID 16188048
Isoxazolo(3,4-d)pyridazin-7(6H)-one, 3,4,6-trimethyl-
CID 33024
N-[2-(1-cyclohexenyl)ethyl]-5-methyl-3-isoxazolecarboxamide
CID 2225132
N-cyclopentyl-5,6,7,8-tetrahydro-4H-cyclohepta[d][1,2]oxazole-3-carboxamide
CID 5128816
3-(Cyclopropylcarbamoyl)-5-methyl-1,2-oxazole-4-carboxylic acid
CID 5325757
Isoxazolo(3,4-d)pyridazin-7(6H)-one, 6-(2-(dimethylamino)ethyl)-3,4-dimethyl-
CID 3039781
Isoxazolo(3,4-d)pyridazin-7(6H)-one, 6-(2-(diethylamino)ethyl)-3,4-dimethyl-
CID 3039782
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(3-methyl-2-morpholin-4-ylbutyl)acetamide
CID 45805111
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-methyl-2-morpholin-4-ylpentyl)acetamide
CID 45805291
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(2-morpholin-4-ylpropyl)acetamide
CID 45812733
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(2-pyrrolidin-1-ylbutyl)acetamide
CID 45887235

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-4,5-dimethyl-1,2-oxazole-3-carboxamide?
The IUPAC name of N-cyclopentyl-4,5-dimethyl-1,2-oxazole-3-carboxamide (CID 19589831) is N-cyclopentyl-4,5-dimethyl-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-cyclopentyl-4,5-dimethyl-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-cyclopentyl-4,5-dimethyl-1,2-oxazole-3-carboxamide is Cc1onc(C(=O)NC2CCCC2)c1C.
What is the InChIKey of N-cyclopentyl-4,5-dimethyl-1,2-oxazole-3-carboxamide?
The InChIKey is HJCYGKSXQDUUPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2/c1-7-8(2)15-13-10(7)11(14)12-9-5-3-4-6-9/h9H,3-6H2,1-2H3,(H,12,14).
What are the key properties of N-cyclopentyl-4,5-dimethyl-1,2-oxazole-3-carboxamide?
N-cyclopentyl-4,5-dimethyl-1,2-oxazole-3-carboxamide has a molecular weight of 208.26 g/mol, XLogP of 1.96, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-4,5-dimethyl-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 19589831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).