N-(6-chloropyrazin-2-yl)-2-(tetrazol-1-yl)acetamide

C7H6ClN7O — CID 115599406

IUPACN-(6-chloropyrazin-2-yl)-2-(tetrazol-1-yl)acetamide
SMILESO=C(Cn1cnnn1)Nc1cncc(Cl)n1
InChIInChI=1S/C7H6ClN7O/c8-5-1-9-2-6(11-5)12-7(16)3-15-4-10-13-14-15/h1-2,4H,3H2,(H,11,12,16)
InChIKeyNTVRRRJOAXELJZ-UHFFFAOYSA-N
MW239.63 g/mol
LogP-0.24
Rot. Bonds3

About N-(6-chloropyrazin-2-yl)-2-(tetrazol-1-yl)acetamide

N-(6-chloropyrazin-2-yl)-2-(tetrazol-1-yl)acetamide (PubChem CID 115599406) has the molecular formula C7H6ClN7O and a molecular weight of 239.63 g/mol. Its IUPAC name is N-(6-chloropyrazin-2-yl)-2-(tetrazol-1-yl)acetamide.

Molecular Properties

Compound NameN-(6-chloropyrazin-2-yl)-2-(tetrazol-1-yl)acetamide
PubChem CID115599406
Molecular FormulaC7H6ClN7O
Molecular Weight239.63 g/mol
Exact Mass239.03
IUPAC NameN-(6-chloropyrazin-2-yl)-2-(tetrazol-1-yl)acetamide
SMILESO=C(Cn1cnnn1)Nc1cncc(Cl)n1
InChIInChI=1S/C7H6ClN7O/c8-5-1-9-2-6(11-5)12-7(16)3-15-4-10-13-14-15/h1-2,4H,3H2,(H,11,12,16)
InChIKeyNTVRRRJOAXELJZ-UHFFFAOYSA-N
XLogP-0.24
TPSA98.48 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.63
LogP ≤ 5-0.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-(4,5-dichloro-3-pyridinyl)-2-(tetrazol-1-yl)acetamide
CID 75448206
N-(6-chloro-2-methyl-3-pyridinyl)-2-(tetrazol-1-yl)acetamide
CID 107301047
N-(5-chloro-8-methylquinolin-2-yl)-2-(tetrazol-1-yl)acetamide
CID 86782318
N-(2,5-dichlorophenyl)-2-(tetrazol-1-yl)acetamide
CID 26086117
N-(6-chloropyrazin-2-yl)butanamide
CID 115599315
N-phenyl-2-(tetrazol-1-yl)acetamide
CID 24977364
N-ethyl-2-(tetrazol-1-yl)acetamide
CID 130679342
N-[4-(diethylamino)phenyl]-2-(tetrazol-1-yl)acetamide
CID 78776629
N-(3-hydroxyphenyl)-2-(tetrazol-1-yl)acetamide
CID 28739859
5-methoxy-2-[[2-(tetrazol-1-yl)acetyl]amino]benzoic acid
CID 78980899
N-[2,6-di(propan-2-yl)phenyl]-2-(tetrazol-1-yl)acetamide
CID 8778733
N-(5-piperazin-1-yl-2-pyridinyl)-2-(tetrazol-1-yl)acetamide;hydrochloride
CID 119260350

Frequently Asked Questions

What is the IUPAC name of N-(6-chloropyrazin-2-yl)-2-(tetrazol-1-yl)acetamide?
The IUPAC name of N-(6-chloropyrazin-2-yl)-2-(tetrazol-1-yl)acetamide (CID 115599406) is N-(6-chloropyrazin-2-yl)-2-(tetrazol-1-yl)acetamide.
What is the SMILES notation for N-(6-chloropyrazin-2-yl)-2-(tetrazol-1-yl)acetamide?
The canonical SMILES for N-(6-chloropyrazin-2-yl)-2-(tetrazol-1-yl)acetamide is O=C(Cn1cnnn1)Nc1cncc(Cl)n1.
What is the InChIKey of N-(6-chloropyrazin-2-yl)-2-(tetrazol-1-yl)acetamide?
The InChIKey is NTVRRRJOAXELJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6ClN7O/c8-5-1-9-2-6(11-5)12-7(16)3-15-4-10-13-14-15/h1-2,4H,3H2,(H,11,12,16).
What are the key properties of N-(6-chloropyrazin-2-yl)-2-(tetrazol-1-yl)acetamide?
N-(6-chloropyrazin-2-yl)-2-(tetrazol-1-yl)acetamide has a molecular weight of 239.63 g/mol, XLogP of -0.24, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-chloropyrazin-2-yl)-2-(tetrazol-1-yl)acetamide is sourced from PubChem (CID 115599406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).