5-(methylamino)-N-(2-methylbutyl)pyrazine-2-carboxamide

C11H18N4O — CID 107375458

IUPAC5-(methylamino)-N-(2-methylbutyl)pyrazine-2-carboxamide
SMILESCCC(C)CNC(=O)c1cnc(NC)cn1
InChIInChI=1S/C11H18N4O/c1-4-8(2)5-15-11(16)9-6-14-10(12-3)7-13-9/h6-8H,4-5H2,1-3H3,(H,12,14)(H,15,16)
InChIKeyCLUVGVSXDSKEAC-UHFFFAOYSA-N
MW222.29 g/mol
LogP1.29
Rot. Bonds5

About 5-(methylamino)-N-(2-methylbutyl)pyrazine-2-carboxamide

5-(methylamino)-N-(2-methylbutyl)pyrazine-2-carboxamide (PubChem CID 107375458) has the molecular formula C11H18N4O and a molecular weight of 222.29 g/mol. Its IUPAC name is 5-(methylamino)-N-(2-methylbutyl)pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-(methylamino)-N-(2-methylbutyl)pyrazine-2-carboxamide
PubChem CID107375458
Molecular FormulaC11H18N4O
Molecular Weight222.29 g/mol
Exact Mass222.15
IUPAC Name5-(methylamino)-N-(2-methylbutyl)pyrazine-2-carboxamide
SMILESCCC(C)CNC(=O)c1cnc(NC)cn1
InChIInChI=1S/C11H18N4O/c1-4-8(2)5-15-11(16)9-6-14-10(12-3)7-13-9/h6-8H,4-5H2,1-3H3,(H,12,14)(H,15,16)
InChIKeyCLUVGVSXDSKEAC-UHFFFAOYSA-N
XLogP1.29
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 51.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,2-dicyclopropylethyl)-5-(methylamino)pyrazine-2-carboxamide
CID 107375993
5-(methylamino)-N-(2-piperidin-1-ylpropyl)pyrazine-2-carboxamide
CID 107375177
N-(2-acetamidoethyl)-5-(methylamino)pyrazine-2-carboxamide
CID 107374531
5-bromo-N-(2-methylbutyl)pyridine-2-carboxamide
CID 55210499
5-hydrazinyl-N-(2-methyl-3-methylsulfanylpropyl)pyrazine-2-carboxamide
CID 107378322
5-(methylamino)-N,N-bis(2-methylpropyl)pyrazine-2-carboxamide
CID 107374736
5-(ethylamino)-N-(3-methyl-2-propan-2-ylbutyl)pyrazine-2-carboxamide
CID 107377215
N-ethyl-5-(methylamino)-N-propan-2-ylpyrazine-2-carboxamide
CID 107374443
5-(aminomethyl)-N-(2-methylbutyl)pyridine-2-carboxamide
CID 63723883
2-(methylamino)-N-(2-methylbutyl)pyridine-4-carboxamide
CID 62694012
5-(methylamino)-N-(1-methylsulfanylpropan-2-yl)pyrazine-2-carboxamide
CID 107376850
5-(butylamino)-N-(2-methylpropyl)pyrazine-2-carboxamide
CID 109272533

Frequently Asked Questions

What is the IUPAC name of 5-(methylamino)-N-(2-methylbutyl)pyrazine-2-carboxamide?
The IUPAC name of 5-(methylamino)-N-(2-methylbutyl)pyrazine-2-carboxamide (CID 107375458) is 5-(methylamino)-N-(2-methylbutyl)pyrazine-2-carboxamide.
What is the SMILES notation for 5-(methylamino)-N-(2-methylbutyl)pyrazine-2-carboxamide?
The canonical SMILES for 5-(methylamino)-N-(2-methylbutyl)pyrazine-2-carboxamide is CCC(C)CNC(=O)c1cnc(NC)cn1.
What is the InChIKey of 5-(methylamino)-N-(2-methylbutyl)pyrazine-2-carboxamide?
The InChIKey is CLUVGVSXDSKEAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O/c1-4-8(2)5-15-11(16)9-6-14-10(12-3)7-13-9/h6-8H,4-5H2,1-3H3,(H,12,14)(H,15,16).
What are the key properties of 5-(methylamino)-N-(2-methylbutyl)pyrazine-2-carboxamide?
5-(methylamino)-N-(2-methylbutyl)pyrazine-2-carboxamide has a molecular weight of 222.29 g/mol, XLogP of 1.29, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(methylamino)-N-(2-methylbutyl)pyrazine-2-carboxamide is sourced from PubChem (CID 107375458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).