2-[(2-methylpropan-2-yl)oxy]-N-[(5-methylpyrazin-2-yl)methyl]acetamide

C12H19N3O2 — CID 112605146

IUPAC2-[(2-methylpropan-2-yl)oxy]-N-[(5-methylpyrazin-2-yl)methyl]acetamide
SMILESCc1cnc(CNC(=O)COC(C)(C)C)cn1
InChIInChI=1S/C12H19N3O2/c1-9-5-14-10(6-13-9)7-15-11(16)8-17-12(2,3)4/h5-6H,7-8H2,1-4H3,(H,15,16)
InChIKeyAIMDCQHZMHRAMB-UHFFFAOYSA-N
MW237.30 g/mol
LogP1.22
Rot. Bonds4

About 2-[(2-methylpropan-2-yl)oxy]-N-[(5-methylpyrazin-2-yl)methyl]acetamide

2-[(2-methylpropan-2-yl)oxy]-N-[(5-methylpyrazin-2-yl)methyl]acetamide (PubChem CID 112605146) has the molecular formula C12H19N3O2 and a molecular weight of 237.30 g/mol. Its IUPAC name is 2-[(2-methylpropan-2-yl)oxy]-N-[(5-methylpyrazin-2-yl)methyl]acetamide.

Molecular Properties

Compound Name2-[(2-methylpropan-2-yl)oxy]-N-[(5-methylpyrazin-2-yl)methyl]acetamide
PubChem CID112605146
Molecular FormulaC12H19N3O2
Molecular Weight237.30 g/mol
Exact Mass237.15
IUPAC Name2-[(2-methylpropan-2-yl)oxy]-N-[(5-methylpyrazin-2-yl)methyl]acetamide
SMILESCc1cnc(CNC(=O)COC(C)(C)C)cn1
InChIInChI=1S/C12H19N3O2/c1-9-5-14-10(6-13-9)7-15-11(16)8-17-12(2,3)4/h5-6H,7-8H2,1-4H3,(H,15,16)
InChIKeyAIMDCQHZMHRAMB-UHFFFAOYSA-N
XLogP1.22
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-methoxy-N-[(5-methylpyrazin-2-yl)methyl]acetamide
CID 64590585
2-[(2-methylpropan-2-yl)oxymethyl]-N-[(5-methylpyrazin-2-yl)methyl]-1,3-thiazole-5-carboxamide
CID 166281118
2-(4-cyanophenoxy)-N-[(5-methylpyrazin-2-yl)methyl]acetamide
CID 62847779
(5-methylpyrazin-2-yl)methylurea
CID 62845946
ethyl N-[(5-methylpyrazin-2-yl)methyl]carbamate
CID 64592018
N-[(5-methylpyrazin-2-yl)methyl]pent-3-ynamide
CID 129060124
2-amino-N-[2-[(5-methylpyrazin-2-yl)methylamino]-2-oxoethyl]acetamide
CID 62847599
3-(aminomethyl)-N-[(5-methylpyrazin-2-yl)methyl]pentanamide
CID 81080396
2-cyano-2-methyl-N-[(5-methylpyrazin-2-yl)methyl]propanamide
CID 55209197
2,2,2-trifluoroethyl N-[(5-methylpyrazin-2-yl)methyl]carbamate
CID 65173800
2-[1-(aminomethyl)cyclobutyl]-N-[(5-methylpyrazin-2-yl)methyl]acetamide
CID 81168792
2-cyano-2-methyl-N-[(5-methylpyrazin-2-yl)methyl]butanamide
CID 113270337

Frequently Asked Questions

What is the IUPAC name of 2-[(2-methylpropan-2-yl)oxy]-N-[(5-methylpyrazin-2-yl)methyl]acetamide?
The IUPAC name of 2-[(2-methylpropan-2-yl)oxy]-N-[(5-methylpyrazin-2-yl)methyl]acetamide (CID 112605146) is 2-[(2-methylpropan-2-yl)oxy]-N-[(5-methylpyrazin-2-yl)methyl]acetamide.
What is the SMILES notation for 2-[(2-methylpropan-2-yl)oxy]-N-[(5-methylpyrazin-2-yl)methyl]acetamide?
The canonical SMILES for 2-[(2-methylpropan-2-yl)oxy]-N-[(5-methylpyrazin-2-yl)methyl]acetamide is Cc1cnc(CNC(=O)COC(C)(C)C)cn1.
What is the InChIKey of 2-[(2-methylpropan-2-yl)oxy]-N-[(5-methylpyrazin-2-yl)methyl]acetamide?
The InChIKey is AIMDCQHZMHRAMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O2/c1-9-5-14-10(6-13-9)7-15-11(16)8-17-12(2,3)4/h5-6H,7-8H2,1-4H3,(H,15,16).
What are the key properties of 2-[(2-methylpropan-2-yl)oxy]-N-[(5-methylpyrazin-2-yl)methyl]acetamide?
2-[(2-methylpropan-2-yl)oxy]-N-[(5-methylpyrazin-2-yl)methyl]acetamide has a molecular weight of 237.30 g/mol, XLogP of 1.22, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-methylpropan-2-yl)oxy]-N-[(5-methylpyrazin-2-yl)methyl]acetamide is sourced from PubChem (CID 112605146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).