N-(4-pyrazin-2-yloxycyclohexyl)-1,2-oxazole-5-carboxamide

C14H16N4O3 — CID 91626018

IUPACN-(4-pyrazin-2-yloxycyclohexyl)-1,2-oxazole-5-carboxamide
SMILESO=C(NC1CCC(Oc2cnccn2)CC1)c1ccno1
InChIInChI=1S/C14H16N4O3/c19-14(12-5-6-17-21-12)18-10-1-3-11(4-2-10)20-13-9-15-7-8-16-13/h5-11H,1-4H2,(H,18,19)
InChIKeySOUVDSVDILJKFW-UHFFFAOYSA-N
MW288.31 g/mol
LogP1.58
Rot. Bonds4

About N-(4-pyrazin-2-yloxycyclohexyl)-1,2-oxazole-5-carboxamide

N-(4-pyrazin-2-yloxycyclohexyl)-1,2-oxazole-5-carboxamide (PubChem CID 91626018) has the molecular formula C14H16N4O3 and a molecular weight of 288.31 g/mol. Its IUPAC name is N-(4-pyrazin-2-yloxycyclohexyl)-1,2-oxazole-5-carboxamide.

Molecular Properties

Compound NameN-(4-pyrazin-2-yloxycyclohexyl)-1,2-oxazole-5-carboxamide
PubChem CID91626018
Molecular FormulaC14H16N4O3
Molecular Weight288.31 g/mol
Exact Mass288.12
IUPAC NameN-(4-pyrazin-2-yloxycyclohexyl)-1,2-oxazole-5-carboxamide
SMILESO=C(NC1CCC(Oc2cnccn2)CC1)c1ccno1
InChIInChI=1S/C14H16N4O3/c19-14(12-5-6-17-21-12)18-10-1-3-11(4-2-10)20-13-9-15-7-8-16-13/h5-11H,1-4H2,(H,18,19)
InChIKeySOUVDSVDILJKFW-UHFFFAOYSA-N
XLogP1.58
TPSA90.14 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.31
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(4-pyrazin-2-yloxycyclohexyl)-1,2-oxazole-5-carboxamide?
The IUPAC name of N-(4-pyrazin-2-yloxycyclohexyl)-1,2-oxazole-5-carboxamide (CID 91626018) is N-(4-pyrazin-2-yloxycyclohexyl)-1,2-oxazole-5-carboxamide.
What is the SMILES notation for N-(4-pyrazin-2-yloxycyclohexyl)-1,2-oxazole-5-carboxamide?
The canonical SMILES for N-(4-pyrazin-2-yloxycyclohexyl)-1,2-oxazole-5-carboxamide is O=C(NC1CCC(Oc2cnccn2)CC1)c1ccno1.
What is the InChIKey of N-(4-pyrazin-2-yloxycyclohexyl)-1,2-oxazole-5-carboxamide?
The InChIKey is SOUVDSVDILJKFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4O3/c19-14(12-5-6-17-21-12)18-10-1-3-11(4-2-10)20-13-9-15-7-8-16-13/h5-11H,1-4H2,(H,18,19).
What are the key properties of N-(4-pyrazin-2-yloxycyclohexyl)-1,2-oxazole-5-carboxamide?
N-(4-pyrazin-2-yloxycyclohexyl)-1,2-oxazole-5-carboxamide has a molecular weight of 288.31 g/mol, XLogP of 1.58, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-pyrazin-2-yloxycyclohexyl)-1,2-oxazole-5-carboxamide is sourced from PubChem (CID 91626018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).