N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]pyrazine-2-carboxamide

C12H14N4O2 — CID 110742839

IUPACN-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]pyrazine-2-carboxamide
SMILESCc1noc(C)c1CCNC(=O)c1cnccn1
InChIInChI=1S/C12H14N4O2/c1-8-10(9(2)18-16-8)3-4-15-12(17)11-7-13-5-6-14-11/h5-7H,3-4H2,1-2H3,(H,15,17)
InChIKeyBWMPAQKCRMXUSC-UHFFFAOYSA-N
MW246.27 g/mol
LogP1.05
Rot. Bonds4

About N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]pyrazine-2-carboxamide

N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]pyrazine-2-carboxamide (PubChem CID 110742839) has the molecular formula C12H14N4O2 and a molecular weight of 246.27 g/mol. Its IUPAC name is N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]pyrazine-2-carboxamide
PubChem CID110742839
Molecular FormulaC12H14N4O2
Molecular Weight246.27 g/mol
Exact Mass246.11
IUPAC NameN-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]pyrazine-2-carboxamide
SMILESCc1noc(C)c1CCNC(=O)c1cnccn1
InChIInChI=1S/C12H14N4O2/c1-8-10(9(2)18-16-8)3-4-15-12(17)11-7-13-5-6-14-11/h5-7H,3-4H2,1-2H3,(H,15,17)
InChIKeyBWMPAQKCRMXUSC-UHFFFAOYSA-N
XLogP1.05
TPSA80.91 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.27
LogP ≤ 51.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-hydroxyethyl)pyrazine-2-carboxamide
CID 14230272
N-[10-(pyrazine-2-carbonylamino)decyl]pyrazine-2-carboxamide
CID 71517100
2,6-dichloro-N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]benzamide
CID 71865203
6-amino-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazine-2-carboxamide
CID 114035994
N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-3-methylbenzamide
CID 110422781
N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-3,4-dimethoxybenzamide
CID 110646263
methyl N-[2-(pyrazine-2-carbonylamino)ethyl]carbamate
CID 108574667
N-[2-(furan-2-yl)ethyl]pyrazine-2-carboxamide
CID 110745469
N-[2-(4-chloro-2,7-dimethyl-1H-indol-3-yl)ethyl]pyrazine-2-carboxamide
CID 39854536
ethyl N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]carbamate
CID 110646305
2-(4-aminophenyl)-N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]acetamide
CID 119778984
N-[3-(3-methylphenyl)propyl]pyrazine-2-carboxamide
CID 110661159

Frequently Asked Questions

What is the IUPAC name of N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]pyrazine-2-carboxamide?
The IUPAC name of N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]pyrazine-2-carboxamide (CID 110742839) is N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]pyrazine-2-carboxamide.
What is the SMILES notation for N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]pyrazine-2-carboxamide?
The canonical SMILES for N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]pyrazine-2-carboxamide is Cc1noc(C)c1CCNC(=O)c1cnccn1.
What is the InChIKey of N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]pyrazine-2-carboxamide?
The InChIKey is BWMPAQKCRMXUSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4O2/c1-8-10(9(2)18-16-8)3-4-15-12(17)11-7-13-5-6-14-11/h5-7H,3-4H2,1-2H3,(H,15,17).
What are the key properties of N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]pyrazine-2-carboxamide?
N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]pyrazine-2-carboxamide has a molecular weight of 246.27 g/mol, XLogP of 1.05, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]pyrazine-2-carboxamide is sourced from PubChem (CID 110742839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).