N-ethyl-N-(2-methylpropyl)-5-propan-2-yl-1,3-oxazole-4-carboxamide

C13H22N2O2 — CID 75370517

IUPACN-ethyl-N-(2-methylpropyl)-5-propan-2-yl-1,3-oxazole-4-carboxamide
SMILESCCN(CC(C)C)C(=O)c1ncoc1C(C)C
InChIInChI=1S/C13H22N2O2/c1-6-15(7-9(2)3)13(16)11-12(10(4)5)17-8-14-11/h8-10H,6-7H2,1-5H3
InChIKeyKVQWOJLWYXHLCI-UHFFFAOYSA-N
MW238.33 g/mol
LogP2.92
Rot. Bonds5

About N-ethyl-N-(2-methylpropyl)-5-propan-2-yl-1,3-oxazole-4-carboxamide

N-ethyl-N-(2-methylpropyl)-5-propan-2-yl-1,3-oxazole-4-carboxamide (PubChem CID 75370517) has the molecular formula C13H22N2O2 and a molecular weight of 238.33 g/mol. Its IUPAC name is N-ethyl-N-(2-methylpropyl)-5-propan-2-yl-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound NameN-ethyl-N-(2-methylpropyl)-5-propan-2-yl-1,3-oxazole-4-carboxamide
PubChem CID75370517
Molecular FormulaC13H22N2O2
Molecular Weight238.33 g/mol
Exact Mass238.17
IUPAC NameN-ethyl-N-(2-methylpropyl)-5-propan-2-yl-1,3-oxazole-4-carboxamide
SMILESCCN(CC(C)C)C(=O)c1ncoc1C(C)C
InChIInChI=1S/C13H22N2O2/c1-6-15(7-9(2)3)13(16)11-12(10(4)5)17-8-14-11/h8-10H,6-7H2,1-5H3
InChIKeyKVQWOJLWYXHLCI-UHFFFAOYSA-N
XLogP2.92
TPSA46.34 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 52.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(2-methylpropyl)-5-propan-2-yl-1,3-oxazole-4-carboxamide?
The IUPAC name of N-ethyl-N-(2-methylpropyl)-5-propan-2-yl-1,3-oxazole-4-carboxamide (CID 75370517) is N-ethyl-N-(2-methylpropyl)-5-propan-2-yl-1,3-oxazole-4-carboxamide.
What is the SMILES notation for N-ethyl-N-(2-methylpropyl)-5-propan-2-yl-1,3-oxazole-4-carboxamide?
The canonical SMILES for N-ethyl-N-(2-methylpropyl)-5-propan-2-yl-1,3-oxazole-4-carboxamide is CCN(CC(C)C)C(=O)c1ncoc1C(C)C.
What is the InChIKey of N-ethyl-N-(2-methylpropyl)-5-propan-2-yl-1,3-oxazole-4-carboxamide?
The InChIKey is KVQWOJLWYXHLCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O2/c1-6-15(7-9(2)3)13(16)11-12(10(4)5)17-8-14-11/h8-10H,6-7H2,1-5H3.
What are the key properties of N-ethyl-N-(2-methylpropyl)-5-propan-2-yl-1,3-oxazole-4-carboxamide?
N-ethyl-N-(2-methylpropyl)-5-propan-2-yl-1,3-oxazole-4-carboxamide has a molecular weight of 238.33 g/mol, XLogP of 2.92, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(2-methylpropyl)-5-propan-2-yl-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 75370517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).