5-methyl-N-[3-oxo-3-(propylamino)propyl]-N-propylpyrazine-2-carboxamide

C15H24N4O2 — CID 4623539

IUPAC5-methyl-N-[3-oxo-3-(propylamino)propyl]-N-propylpyrazine-2-carboxamide
SMILESCCCNC(=O)CCN(CCC)C(=O)c1cnc(C)cn1
InChIInChI=1S/C15H24N4O2/c1-4-7-16-14(20)6-9-19(8-5-2)15(21)13-11-17-12(3)10-18-13/h10-11H,4-9H2,1-3H3,(H,16,20)
InChIKeyRYZZCZPIVNQFES-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.55
Rot. Bonds8

About 5-methyl-N-[3-oxo-3-(propylamino)propyl]-N-propylpyrazine-2-carboxamide

5-methyl-N-[3-oxo-3-(propylamino)propyl]-N-propylpyrazine-2-carboxamide (PubChem CID 4623539) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is 5-methyl-N-[3-oxo-3-(propylamino)propyl]-N-propylpyrazine-2-carboxamide.

Molecular Properties

Compound Name5-methyl-N-[3-oxo-3-(propylamino)propyl]-N-propylpyrazine-2-carboxamide
PubChem CID4623539
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC Name5-methyl-N-[3-oxo-3-(propylamino)propyl]-N-propylpyrazine-2-carboxamide
SMILESCCCNC(=O)CCN(CCC)C(=O)c1cnc(C)cn1
InChIInChI=1S/C15H24N4O2/c1-4-7-16-14(20)6-9-19(8-5-2)15(21)13-11-17-12(3)10-18-13/h10-11H,4-9H2,1-3H3,(H,16,20)
InChIKeyRYZZCZPIVNQFES-UHFFFAOYSA-N
XLogP1.55
TPSA75.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-[(4-fluorophenyl)methylamino]-3-oxopropyl]-5-methyl-N-propylpyrazine-2-carboxamide
CID 4136501
N-hexyl-N-[3-(3-methoxypropylamino)-3-oxopropyl]-5-methylpyrazine-2-carboxamide
CID 7271476
5-methyl-N-[3-oxo-3-(2-piperidin-1-ium-1-ylethylamino)propyl]-N-(2-piperidin-1-ium-1-ylethyl)pyrazine-2-carboxamide
CID 7263419
ethyl 4-[3-[(5-methylpyrazine-2-carbonyl)-propylamino]propanoyl]piperazine-1-carboxylate
CID 4658031
N-benzyl-N-[3-(butylamino)-3-oxopropyl]-5-methylpyrazine-2-carboxamide
CID 4284505
N-hexyl-5-methyl-N-[3-(2-methylpropylamino)-3-oxopropyl]pyrazine-2-carboxamide
CID 7271625
N-[3-(4-ethylpiperazin-1-yl)-3-oxopropyl]-5-methyl-N-propylpyrazine-2-carboxamide
CID 3533297
5-methyl-N-[3-oxo-3-[[3-(trifluoromethyl)phenyl]methylamino]propyl]-N-propylpyrazine-2-carboxamide
CID 4170520
diethyl-[(4S)-4-[3-[(5-methylpyrazine-2-carbonyl)-propylamino]propanoylamino]pentyl]azanium
CID 7293187
5-methyl-N-[3-(3-methylbutylamino)-3-oxopropyl]-N-(2-phenylethyl)pyrazine-2-carboxamide
CID 4150125
5-methyl-N-propylpyrazine-2-carboxamide
CID 60637750
N-[3-(hexylamino)-3-oxopropyl]-5-methyl-N-[[(2S)-oxolan-2-yl]methyl]pyrazine-2-carboxamide
CID 7237889

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-[3-oxo-3-(propylamino)propyl]-N-propylpyrazine-2-carboxamide?
The IUPAC name of 5-methyl-N-[3-oxo-3-(propylamino)propyl]-N-propylpyrazine-2-carboxamide (CID 4623539) is 5-methyl-N-[3-oxo-3-(propylamino)propyl]-N-propylpyrazine-2-carboxamide.
What is the SMILES notation for 5-methyl-N-[3-oxo-3-(propylamino)propyl]-N-propylpyrazine-2-carboxamide?
The canonical SMILES for 5-methyl-N-[3-oxo-3-(propylamino)propyl]-N-propylpyrazine-2-carboxamide is CCCNC(=O)CCN(CCC)C(=O)c1cnc(C)cn1.
What is the InChIKey of 5-methyl-N-[3-oxo-3-(propylamino)propyl]-N-propylpyrazine-2-carboxamide?
The InChIKey is RYZZCZPIVNQFES-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-4-7-16-14(20)6-9-19(8-5-2)15(21)13-11-17-12(3)10-18-13/h10-11H,4-9H2,1-3H3,(H,16,20).
What are the key properties of 5-methyl-N-[3-oxo-3-(propylamino)propyl]-N-propylpyrazine-2-carboxamide?
5-methyl-N-[3-oxo-3-(propylamino)propyl]-N-propylpyrazine-2-carboxamide has a molecular weight of 292.38 g/mol, XLogP of 1.55, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-[3-oxo-3-(propylamino)propyl]-N-propylpyrazine-2-carboxamide is sourced from PubChem (CID 4623539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).