N-(1H-pyrazol-5-yl)-2-(5-thiophen-2-yltetrazol-2-yl)acetamide

C10H9N7OS — CID 61393718

IUPACN-(1H-pyrazol-5-yl)-2-(5-thiophen-2-yltetrazol-2-yl)acetamide
SMILESO=C(Cn1nnc(-c2cccs2)n1)Nc1ccn[nH]1
InChIInChI=1S/C10H9N7OS/c18-9(12-8-3-4-11-13-8)6-17-15-10(14-16-17)7-2-1-5-19-7/h1-5H,6H2,(H2,11,12,13,18)
InChIKeyGKPDGLYZQVCRRG-UHFFFAOYSA-N
MW275.30 g/mol
LogP0.76
Rot. Bonds4

About N-(1H-pyrazol-5-yl)-2-(5-thiophen-2-yltetrazol-2-yl)acetamide

N-(1H-pyrazol-5-yl)-2-(5-thiophen-2-yltetrazol-2-yl)acetamide (PubChem CID 61393718) has the molecular formula C10H9N7OS and a molecular weight of 275.30 g/mol. Its IUPAC name is N-(1H-pyrazol-5-yl)-2-(5-thiophen-2-yltetrazol-2-yl)acetamide.

Molecular Properties

Compound NameN-(1H-pyrazol-5-yl)-2-(5-thiophen-2-yltetrazol-2-yl)acetamide
PubChem CID61393718
Molecular FormulaC10H9N7OS
Molecular Weight275.30 g/mol
Exact Mass275.06
IUPAC NameN-(1H-pyrazol-5-yl)-2-(5-thiophen-2-yltetrazol-2-yl)acetamide
SMILESO=C(Cn1nnc(-c2cccs2)n1)Nc1ccn[nH]1
InChIInChI=1S/C10H9N7OS/c18-9(12-8-3-4-11-13-8)6-17-15-10(14-16-17)7-2-1-5-19-7/h1-5H,6H2,(H2,11,12,13,18)
InChIKeyGKPDGLYZQVCRRG-UHFFFAOYSA-N
XLogP0.76
TPSA101.38 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.30
LogP ≤ 50.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-(1H-pyrazol-5-yl)-2-(5-thiophen-2-yltetrazol-2-yl)acetamide?
The IUPAC name of N-(1H-pyrazol-5-yl)-2-(5-thiophen-2-yltetrazol-2-yl)acetamide (CID 61393718) is N-(1H-pyrazol-5-yl)-2-(5-thiophen-2-yltetrazol-2-yl)acetamide.
What is the SMILES notation for N-(1H-pyrazol-5-yl)-2-(5-thiophen-2-yltetrazol-2-yl)acetamide?
The canonical SMILES for N-(1H-pyrazol-5-yl)-2-(5-thiophen-2-yltetrazol-2-yl)acetamide is O=C(Cn1nnc(-c2cccs2)n1)Nc1ccn[nH]1.
What is the InChIKey of N-(1H-pyrazol-5-yl)-2-(5-thiophen-2-yltetrazol-2-yl)acetamide?
The InChIKey is GKPDGLYZQVCRRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N7OS/c18-9(12-8-3-4-11-13-8)6-17-15-10(14-16-17)7-2-1-5-19-7/h1-5H,6H2,(H2,11,12,13,18).
What are the key properties of N-(1H-pyrazol-5-yl)-2-(5-thiophen-2-yltetrazol-2-yl)acetamide?
N-(1H-pyrazol-5-yl)-2-(5-thiophen-2-yltetrazol-2-yl)acetamide has a molecular weight of 275.30 g/mol, XLogP of 0.76, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-pyrazol-5-yl)-2-(5-thiophen-2-yltetrazol-2-yl)acetamide is sourced from PubChem (CID 61393718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).