N-(4,5-dichloro-3-pyridinyl)-2-(tetrazol-1-yl)acetamide

C8H6Cl2N6O — CID 75448206

IUPACN-(4,5-dichloro-3-pyridinyl)-2-(tetrazol-1-yl)acetamide
SMILESO=C(Cn1cnnn1)Nc1cncc(Cl)c1Cl
InChIInChI=1S/C8H6Cl2N6O/c9-5-1-11-2-6(8(5)10)13-7(17)3-16-4-12-14-15-16/h1-2,4H,3H2,(H,13,17)
InChIKeyGRVOUFHOICYZAC-UHFFFAOYSA-N
MW273.08 g/mol
LogP1.01
Rot. Bonds3

About N-(4,5-dichloro-3-pyridinyl)-2-(tetrazol-1-yl)acetamide

N-(4,5-dichloro-3-pyridinyl)-2-(tetrazol-1-yl)acetamide (PubChem CID 75448206) has the molecular formula C8H6Cl2N6O and a molecular weight of 273.08 g/mol. Its IUPAC name is N-(4,5-dichloro-3-pyridinyl)-2-(tetrazol-1-yl)acetamide.

Molecular Properties

Compound NameN-(4,5-dichloro-3-pyridinyl)-2-(tetrazol-1-yl)acetamide
PubChem CID75448206
Molecular FormulaC8H6Cl2N6O
Molecular Weight273.08 g/mol
Exact Mass272.00
IUPAC NameN-(4,5-dichloro-3-pyridinyl)-2-(tetrazol-1-yl)acetamide
SMILESO=C(Cn1cnnn1)Nc1cncc(Cl)c1Cl
InChIInChI=1S/C8H6Cl2N6O/c9-5-1-11-2-6(8(5)10)13-7(17)3-16-4-12-14-15-16/h1-2,4H,3H2,(H,13,17)
InChIKeyGRVOUFHOICYZAC-UHFFFAOYSA-N
XLogP1.01
TPSA85.59 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.08
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(6-chloropyrazin-2-yl)-2-(tetrazol-1-yl)acetamide
CID 115599406
N-(2,5-dichlorophenyl)-2-(tetrazol-1-yl)acetamide
CID 26086117
N-(6-chloro-2-methyl-3-pyridinyl)-2-(tetrazol-1-yl)acetamide
CID 107301047
N-phenyl-2-(tetrazol-1-yl)acetamide
CID 24977364
N-(5-chloro-8-methylquinolin-2-yl)-2-(tetrazol-1-yl)acetamide
CID 86782318
N-(3-bromoquinolin-8-yl)-2-(tetrazol-1-yl)acetamide
CID 116784723
N-[2-(difluoromethylsulfanyl)phenyl]-2-(tetrazol-1-yl)acetamide
CID 52896191
N-(2-propan-2-ylsulfanylphenyl)-2-(tetrazol-1-yl)acetamide
CID 167901485
N-[5-chloro-2-(4-fluorophenyl)sulfanylphenyl]-2-(tetrazol-1-yl)acetamide
CID 17470876
N-ethyl-2-(tetrazol-1-yl)acetamide
CID 130679342
N-(1-benzyl-2-oxo-3-pyridinyl)-2-(tetrazol-1-yl)acetamide
CID 71856302
N-[4-(diethylamino)phenyl]-2-(tetrazol-1-yl)acetamide
CID 78776629

Frequently Asked Questions

What is the IUPAC name of N-(4,5-dichloro-3-pyridinyl)-2-(tetrazol-1-yl)acetamide?
The IUPAC name of N-(4,5-dichloro-3-pyridinyl)-2-(tetrazol-1-yl)acetamide (CID 75448206) is N-(4,5-dichloro-3-pyridinyl)-2-(tetrazol-1-yl)acetamide.
What is the SMILES notation for N-(4,5-dichloro-3-pyridinyl)-2-(tetrazol-1-yl)acetamide?
The canonical SMILES for N-(4,5-dichloro-3-pyridinyl)-2-(tetrazol-1-yl)acetamide is O=C(Cn1cnnn1)Nc1cncc(Cl)c1Cl.
What is the InChIKey of N-(4,5-dichloro-3-pyridinyl)-2-(tetrazol-1-yl)acetamide?
The InChIKey is GRVOUFHOICYZAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6Cl2N6O/c9-5-1-11-2-6(8(5)10)13-7(17)3-16-4-12-14-15-16/h1-2,4H,3H2,(H,13,17).
What are the key properties of N-(4,5-dichloro-3-pyridinyl)-2-(tetrazol-1-yl)acetamide?
N-(4,5-dichloro-3-pyridinyl)-2-(tetrazol-1-yl)acetamide has a molecular weight of 273.08 g/mol, XLogP of 1.01, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,5-dichloro-3-pyridinyl)-2-(tetrazol-1-yl)acetamide is sourced from PubChem (CID 75448206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).