2-(2,3-dihydrotetrazol-1-yl)-N-(1H-pyrazol-4-yl)acetamide

C6H9N7O — CID 58591104

IUPAC2-(2,3-dihydrotetrazol-1-yl)-N-(1H-pyrazol-4-yl)acetamide
SMILESO=C(CN1C=NNN1)Nc1cn[nH]c1
InChIInChI=1S/C6H9N7O/c14-6(3-13-4-9-11-12-13)10-5-1-7-8-2-5/h1-2,4,11-12H,3H2,(H,7,8)(H,10,14)
InChIKeyAVQXORHTJJAHOM-UHFFFAOYSA-N
MW195.19 g/mol
LogP-1.38
Rot. Bonds3

About 2-(2,3-dihydrotetrazol-1-yl)-N-(1H-pyrazol-4-yl)acetamide

2-(2,3-dihydrotetrazol-1-yl)-N-(1H-pyrazol-4-yl)acetamide (PubChem CID 58591104) has the molecular formula C6H9N7O and a molecular weight of 195.19 g/mol. Its IUPAC name is 2-(2,3-dihydrotetrazol-1-yl)-N-(1H-pyrazol-4-yl)acetamide.

Molecular Properties

Compound Name2-(2,3-dihydrotetrazol-1-yl)-N-(1H-pyrazol-4-yl)acetamide
PubChem CID58591104
Molecular FormulaC6H9N7O
Molecular Weight195.19 g/mol
Exact Mass195.09
IUPAC Name2-(2,3-dihydrotetrazol-1-yl)-N-(1H-pyrazol-4-yl)acetamide
SMILESO=C(CN1C=NNN1)Nc1cn[nH]c1
InChIInChI=1S/C6H9N7O/c14-6(3-13-4-9-11-12-13)10-5-1-7-8-2-5/h1-2,4,11-12H,3H2,(H,7,8)(H,10,14)
InChIKeyAVQXORHTJJAHOM-UHFFFAOYSA-N
XLogP-1.38
TPSA97.44 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.19
LogP ≤ 5-1.38
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

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Related Compounds

4-Acetylaminopyrazole
CID 12346894
N-(1H-pyrazol-4-yl)but-2-ynamide hydrochloride
CID 155820287
3-amino-2-methyl-N-(1H-pyrazol-4-yl)propanamide
CID 54592830
2-[cyclopropyl(ethyl)amino]-N-(1H-pyrazol-4-yl)acetamide
CID 136517020
2,2,2-Trifluoro-N-(1H-pyrazol-4-yl)acetamide
CID 60999972
N-(1H-pyrazol-4-yl)-2-(2,2,2-trifluoroethylamino)acetamide
CID 78924535
2,2-difluoro-N-(1H-pyrazol-4-yl)acetamide
CID 103514029
N-(1H-pyrazol-4-yl)but-2-ynamide
CID 107261723
N-(1H-pyrazol-4-yl)butanamide
CID 13450485
2-(dimethylamino)-N-(1H-pyrazol-4-yl)acetamide
CID 20784744
2-methyl-N-(1H-pyrazol-4-yl)propanamide
CID 20784752
N-(1H-pyrazol-4-yl)propanamide
CID 43429417

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydrotetrazol-1-yl)-N-(1H-pyrazol-4-yl)acetamide?
The IUPAC name of 2-(2,3-dihydrotetrazol-1-yl)-N-(1H-pyrazol-4-yl)acetamide (CID 58591104) is 2-(2,3-dihydrotetrazol-1-yl)-N-(1H-pyrazol-4-yl)acetamide.
What is the SMILES notation for 2-(2,3-dihydrotetrazol-1-yl)-N-(1H-pyrazol-4-yl)acetamide?
The canonical SMILES for 2-(2,3-dihydrotetrazol-1-yl)-N-(1H-pyrazol-4-yl)acetamide is O=C(CN1C=NNN1)Nc1cn[nH]c1.
What is the InChIKey of 2-(2,3-dihydrotetrazol-1-yl)-N-(1H-pyrazol-4-yl)acetamide?
The InChIKey is AVQXORHTJJAHOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N7O/c14-6(3-13-4-9-11-12-13)10-5-1-7-8-2-5/h1-2,4,11-12H,3H2,(H,7,8)(H,10,14).
What are the key properties of 2-(2,3-dihydrotetrazol-1-yl)-N-(1H-pyrazol-4-yl)acetamide?
2-(2,3-dihydrotetrazol-1-yl)-N-(1H-pyrazol-4-yl)acetamide has a molecular weight of 195.19 g/mol, XLogP of -1.38, 3 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydrotetrazol-1-yl)-N-(1H-pyrazol-4-yl)acetamide is sourced from PubChem (CID 58591104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).