6-methyl-N-propylpyrazine-2-carboxamide

C9H13N3O — CID 54299010

IUPAC6-methyl-N-propylpyrazine-2-carboxamide
SMILESCCCNC(=O)c1cncc(C)n1
InChIInChI=1S/C9H13N3O/c1-3-4-11-9(13)8-6-10-5-7(2)12-8/h5-6H,3-4H2,1-2H3,(H,11,13)
InChIKeySCVUHPBNFRINHL-UHFFFAOYSA-N
MW179.22 g/mol
LogP0.92
Rot. Bonds3

About 6-methyl-N-propylpyrazine-2-carboxamide

6-methyl-N-propylpyrazine-2-carboxamide (PubChem CID 54299010) has the molecular formula C9H13N3O and a molecular weight of 179.22 g/mol. Its IUPAC name is 6-methyl-N-propylpyrazine-2-carboxamide.

Molecular Properties

Compound Name6-methyl-N-propylpyrazine-2-carboxamide
PubChem CID54299010
Molecular FormulaC9H13N3O
Molecular Weight179.22 g/mol
Exact Mass179.11
IUPAC Name6-methyl-N-propylpyrazine-2-carboxamide
SMILESCCCNC(=O)c1cncc(C)n1
InChIInChI=1S/C9H13N3O/c1-3-4-11-9(13)8-6-10-5-7(2)12-8/h5-6H,3-4H2,1-2H3,(H,11,13)
InChIKeySCVUHPBNFRINHL-UHFFFAOYSA-N
XLogP0.92
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.22
LogP ≤ 50.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-methyl-4-propan-2-yl-N-propylpyridine-2-carboxamide
CID 142843630
5-methyl-N-propylpyrazine-2-carboxamide
CID 60637750
6-methyl-N-[3-(propylcarbamoylamino)-1-adamantyl]pyrazine-2-carboxamide
CID 53327009
3-N,5-N-dipropylpyridine-3,5-dicarboxamide
CID 47231705
N-[2-(1H-indol-3-yl)ethyl]-6-methylpyrazine-2-carboxamide
CID 146080613
6-methyl-N-propylpyridazine-3-carboxamide
CID 110705181
6-methyl-N-propylpyrimidine-4-carboxamide
CID 110847771
6-(ethylamino)-N-hexylpyrazine-2-carboxamide
CID 114035955
N-propyl-2H-triazole-4-carboxamide
CID 54219715
6-(propylamino)-N-(2,2,2-trifluoroethyl)pyrazine-2-carboxamide
CID 114035608
6-amino-N-[(1-propylcyclopropyl)methyl]pyrazine-2-carboxamide
CID 114101902
N-propyl-6-[6-(propylcarbamoyl)-2-pyridinyl]pyridine-2-carboxamide
CID 10980324

Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-propylpyrazine-2-carboxamide?
The IUPAC name of 6-methyl-N-propylpyrazine-2-carboxamide (CID 54299010) is 6-methyl-N-propylpyrazine-2-carboxamide.
What is the SMILES notation for 6-methyl-N-propylpyrazine-2-carboxamide?
The canonical SMILES for 6-methyl-N-propylpyrazine-2-carboxamide is CCCNC(=O)c1cncc(C)n1.
What is the InChIKey of 6-methyl-N-propylpyrazine-2-carboxamide?
The InChIKey is SCVUHPBNFRINHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O/c1-3-4-11-9(13)8-6-10-5-7(2)12-8/h5-6H,3-4H2,1-2H3,(H,11,13).
What are the key properties of 6-methyl-N-propylpyrazine-2-carboxamide?
6-methyl-N-propylpyrazine-2-carboxamide has a molecular weight of 179.22 g/mol, XLogP of 0.92, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-propylpyrazine-2-carboxamide is sourced from PubChem (CID 54299010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).