N-(1-methoxypropan-2-yl)-2-[(5-methylpyrazin-2-yl)methylamino]acetamide

C12H20N4O2 — CID 62846636

IUPACN-(1-methoxypropan-2-yl)-2-[(5-methylpyrazin-2-yl)methylamino]acetamide
SMILESCOCC(C)NC(=O)CNCc1cnc(C)cn1
InChIInChI=1S/C12H20N4O2/c1-9-4-15-11(6-14-9)5-13-7-12(17)16-10(2)8-18-3/h4,6,10,13H,5,7-8H2,1-3H3,(H,16,17)
InChIKeyVVNMPSWUTFSNIU-UHFFFAOYSA-N
MW252.32 g/mol
LogP0.03
Rot. Bonds7

About N-(1-methoxypropan-2-yl)-2-[(5-methylpyrazin-2-yl)methylamino]acetamide

N-(1-methoxypropan-2-yl)-2-[(5-methylpyrazin-2-yl)methylamino]acetamide (PubChem CID 62846636) has the molecular formula C12H20N4O2 and a molecular weight of 252.32 g/mol. Its IUPAC name is N-(1-methoxypropan-2-yl)-2-[(5-methylpyrazin-2-yl)methylamino]acetamide.

Molecular Properties

Compound NameN-(1-methoxypropan-2-yl)-2-[(5-methylpyrazin-2-yl)methylamino]acetamide
PubChem CID62846636
Molecular FormulaC12H20N4O2
Molecular Weight252.32 g/mol
Exact Mass252.16
IUPAC NameN-(1-methoxypropan-2-yl)-2-[(5-methylpyrazin-2-yl)methylamino]acetamide
SMILESCOCC(C)NC(=O)CNCc1cnc(C)cn1
InChIInChI=1S/C12H20N4O2/c1-9-4-15-11(6-14-9)5-13-7-12(17)16-10(2)8-18-3/h4,6,10,13H,5,7-8H2,1-3H3,(H,16,17)
InChIKeyVVNMPSWUTFSNIU-UHFFFAOYSA-N
XLogP0.03
TPSA76.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 50.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(1-methoxypropan-2-yl)-2-[(5-methylpyrazin-2-yl)methylamino]acetamide?
The IUPAC name of N-(1-methoxypropan-2-yl)-2-[(5-methylpyrazin-2-yl)methylamino]acetamide (CID 62846636) is N-(1-methoxypropan-2-yl)-2-[(5-methylpyrazin-2-yl)methylamino]acetamide.
What is the SMILES notation for N-(1-methoxypropan-2-yl)-2-[(5-methylpyrazin-2-yl)methylamino]acetamide?
The canonical SMILES for N-(1-methoxypropan-2-yl)-2-[(5-methylpyrazin-2-yl)methylamino]acetamide is COCC(C)NC(=O)CNCc1cnc(C)cn1.
What is the InChIKey of N-(1-methoxypropan-2-yl)-2-[(5-methylpyrazin-2-yl)methylamino]acetamide?
The InChIKey is VVNMPSWUTFSNIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O2/c1-9-4-15-11(6-14-9)5-13-7-12(17)16-10(2)8-18-3/h4,6,10,13H,5,7-8H2,1-3H3,(H,16,17).
What are the key properties of N-(1-methoxypropan-2-yl)-2-[(5-methylpyrazin-2-yl)methylamino]acetamide?
N-(1-methoxypropan-2-yl)-2-[(5-methylpyrazin-2-yl)methylamino]acetamide has a molecular weight of 252.32 g/mol, XLogP of 0.03, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methoxypropan-2-yl)-2-[(5-methylpyrazin-2-yl)methylamino]acetamide is sourced from PubChem (CID 62846636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).