N-cyclohexyl-5-[(6-methyl-3-pyridinyl)oxymethyl]-1,2-oxazole-3-carboxamide

C17H21N3O3 — CID 24791132

IUPACN-cyclohexyl-5-[(6-methyl-3-pyridinyl)oxymethyl]-1,2-oxazole-3-carboxamide
SMILESCc1ccc(OCc2cc(C(=O)NC3CCCCC3)no2)cn1
InChIInChI=1S/C17H21N3O3/c1-12-7-8-14(10-18-12)22-11-15-9-16(20-23-15)17(21)19-13-5-3-2-4-6-13/h7-10,13H,2-6,11H2,1H3,(H,19,21)
InChIKeyKWJWCKOSVMZUEH-UHFFFAOYSA-N
MW315.37 g/mol
LogP3.02
Rot. Bonds5

About N-cyclohexyl-5-[(6-methyl-3-pyridinyl)oxymethyl]-1,2-oxazole-3-carboxamide

N-cyclohexyl-5-[(6-methyl-3-pyridinyl)oxymethyl]-1,2-oxazole-3-carboxamide (PubChem CID 24791132) has the molecular formula C17H21N3O3 and a molecular weight of 315.37 g/mol. Its IUPAC name is N-cyclohexyl-5-[(6-methyl-3-pyridinyl)oxymethyl]-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-5-[(6-methyl-3-pyridinyl)oxymethyl]-1,2-oxazole-3-carboxamide
PubChem CID24791132
Molecular FormulaC17H21N3O3
Molecular Weight315.37 g/mol
Exact Mass315.16
IUPAC NameN-cyclohexyl-5-[(6-methyl-3-pyridinyl)oxymethyl]-1,2-oxazole-3-carboxamide
SMILESCc1ccc(OCc2cc(C(=O)NC3CCCCC3)no2)cn1
InChIInChI=1S/C17H21N3O3/c1-12-7-8-14(10-18-12)22-11-15-9-16(20-23-15)17(21)19-13-5-3-2-4-6-13/h7-10,13H,2-6,11H2,1H3,(H,19,21)
InChIKeyKWJWCKOSVMZUEH-UHFFFAOYSA-N
XLogP3.02
TPSA77.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.37
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-5-[(6-methyl-3-pyridinyl)oxymethyl]-1,2-oxazole-3-carboxamide?
The IUPAC name of N-cyclohexyl-5-[(6-methyl-3-pyridinyl)oxymethyl]-1,2-oxazole-3-carboxamide (CID 24791132) is N-cyclohexyl-5-[(6-methyl-3-pyridinyl)oxymethyl]-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-cyclohexyl-5-[(6-methyl-3-pyridinyl)oxymethyl]-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-cyclohexyl-5-[(6-methyl-3-pyridinyl)oxymethyl]-1,2-oxazole-3-carboxamide is Cc1ccc(OCc2cc(C(=O)NC3CCCCC3)no2)cn1.
What is the InChIKey of N-cyclohexyl-5-[(6-methyl-3-pyridinyl)oxymethyl]-1,2-oxazole-3-carboxamide?
The InChIKey is KWJWCKOSVMZUEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O3/c1-12-7-8-14(10-18-12)22-11-15-9-16(20-23-15)17(21)19-13-5-3-2-4-6-13/h7-10,13H,2-6,11H2,1H3,(H,19,21).
What are the key properties of N-cyclohexyl-5-[(6-methyl-3-pyridinyl)oxymethyl]-1,2-oxazole-3-carboxamide?
N-cyclohexyl-5-[(6-methyl-3-pyridinyl)oxymethyl]-1,2-oxazole-3-carboxamide has a molecular weight of 315.37 g/mol, XLogP of 3.02, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-5-[(6-methyl-3-pyridinyl)oxymethyl]-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 24791132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).