N-(5-chloropyrazin-2-yl)pentanamide

C9H12ClN3O — CID 104964179

IUPACN-(5-chloropyrazin-2-yl)pentanamide
SMILESCCCCC(=O)Nc1cnc(Cl)cn1
InChIInChI=1S/C9H12ClN3O/c1-2-3-4-9(14)13-8-6-11-7(10)5-12-8/h5-6H,2-4H2,1H3,(H,12,13,14)
InChIKeyOYQJGNGJHOZBEG-UHFFFAOYSA-N
MW213.67 g/mol
LogP2.26
Rot. Bonds4

About N-(5-chloropyrazin-2-yl)pentanamide

N-(5-chloropyrazin-2-yl)pentanamide (PubChem CID 104964179) has the molecular formula C9H12ClN3O and a molecular weight of 213.67 g/mol. Its IUPAC name is N-(5-chloropyrazin-2-yl)pentanamide.

Molecular Properties

Compound NameN-(5-chloropyrazin-2-yl)pentanamide
PubChem CID104964179
Molecular FormulaC9H12ClN3O
Molecular Weight213.67 g/mol
Exact Mass213.07
IUPAC NameN-(5-chloropyrazin-2-yl)pentanamide
SMILESCCCCC(=O)Nc1cnc(Cl)cn1
InChIInChI=1S/C9H12ClN3O/c1-2-3-4-9(14)13-8-6-11-7(10)5-12-8/h5-6H,2-4H2,1H3,(H,12,13,14)
InChIKeyOYQJGNGJHOZBEG-UHFFFAOYSA-N
XLogP2.26
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.67
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(6-chloropyrazin-2-yl)acetamide
CID 14787673
N-pyrazin-2-yldodecanamide
CID 118730973
N-Palmitoylpyrazinamide
CID 131909
N-(5-chloropyrazin-2-yl)acetamide
CID 23273497
N-[1-(6-chloropyrazin-2-yl)piperidin-3-yl]acetamide
CID 71978068
4,4,4-trifluoro-N-pyrazin-2-ylbutanamide
CID 75508760
(2R)-N-(6-chloropyrazin-2-yl)-3-methyl-2-(2,2,2-trifluoroethylamino)butanamide
CID 89405087
N-(3-chloropyrazin-2-yl)-4,4,4-trifluorobutanamide
CID 102989167
(2S,4R)-N-(6-chloropyrazin-2-yl)-4-fluoropyrrolidine-2-carboxamide
CID 126643207
(2S,4R)-N-chloro-N-(6-chloropyrazin-2-yl)-4-fluoropyrrolidine-2-carboxamide
CID 140318923
N-(6-chloropyrazin-2-yl)-4-fluoropyrrolidine-2-carboxamide
CID 140776799
1-(6-Chloropyrazin-2-yl)-4-fluoropyrrolidine-2-carboxamide
CID 156766270

Frequently Asked Questions

What is the IUPAC name of N-(5-chloropyrazin-2-yl)pentanamide?
The IUPAC name of N-(5-chloropyrazin-2-yl)pentanamide (CID 104964179) is N-(5-chloropyrazin-2-yl)pentanamide.
What is the SMILES notation for N-(5-chloropyrazin-2-yl)pentanamide?
The canonical SMILES for N-(5-chloropyrazin-2-yl)pentanamide is CCCCC(=O)Nc1cnc(Cl)cn1.
What is the InChIKey of N-(5-chloropyrazin-2-yl)pentanamide?
The InChIKey is OYQJGNGJHOZBEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12ClN3O/c1-2-3-4-9(14)13-8-6-11-7(10)5-12-8/h5-6H,2-4H2,1H3,(H,12,13,14).
What are the key properties of N-(5-chloropyrazin-2-yl)pentanamide?
N-(5-chloropyrazin-2-yl)pentanamide has a molecular weight of 213.67 g/mol, XLogP of 2.26, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloropyrazin-2-yl)pentanamide is sourced from PubChem (CID 104964179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).