N-[2-methoxy-1-(2-methylpyrazol-3-yl)ethyl]-2-(tetrazol-1-yl)acetamide

C10H15N7O2 — CID 91795894

IUPACN-[2-methoxy-1-(2-methylpyrazol-3-yl)ethyl]-2-(tetrazol-1-yl)acetamide
SMILESCOCC(NC(=O)Cn1cnnn1)c1ccnn1C
InChIInChI=1S/C10H15N7O2/c1-16-9(3-4-12-16)8(6-19-2)13-10(18)5-17-7-11-14-15-17/h3-4,7-8H,5-6H2,1-2H3,(H,13,18)
InChIKeyXJZVOHRRDGPUFJ-UHFFFAOYSA-N
MW265.28 g/mol
LogP-1.09
Rot. Bonds6

About N-[2-methoxy-1-(2-methylpyrazol-3-yl)ethyl]-2-(tetrazol-1-yl)acetamide

N-[2-methoxy-1-(2-methylpyrazol-3-yl)ethyl]-2-(tetrazol-1-yl)acetamide (PubChem CID 91795894) has the molecular formula C10H15N7O2 and a molecular weight of 265.28 g/mol. Its IUPAC name is N-[2-methoxy-1-(2-methylpyrazol-3-yl)ethyl]-2-(tetrazol-1-yl)acetamide.

Molecular Properties

Compound NameN-[2-methoxy-1-(2-methylpyrazol-3-yl)ethyl]-2-(tetrazol-1-yl)acetamide
PubChem CID91795894
Molecular FormulaC10H15N7O2
Molecular Weight265.28 g/mol
Exact Mass265.13
IUPAC NameN-[2-methoxy-1-(2-methylpyrazol-3-yl)ethyl]-2-(tetrazol-1-yl)acetamide
SMILESCOCC(NC(=O)Cn1cnnn1)c1ccnn1C
InChIInChI=1S/C10H15N7O2/c1-16-9(3-4-12-16)8(6-19-2)13-10(18)5-17-7-11-14-15-17/h3-4,7-8H,5-6H2,1-2H3,(H,13,18)
InChIKeyXJZVOHRRDGPUFJ-UHFFFAOYSA-N
XLogP-1.09
TPSA99.75 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.28
LogP ≤ 5-1.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of N-[2-methoxy-1-(2-methylpyrazol-3-yl)ethyl]-2-(tetrazol-1-yl)acetamide?
The IUPAC name of N-[2-methoxy-1-(2-methylpyrazol-3-yl)ethyl]-2-(tetrazol-1-yl)acetamide (CID 91795894) is N-[2-methoxy-1-(2-methylpyrazol-3-yl)ethyl]-2-(tetrazol-1-yl)acetamide.
What is the SMILES notation for N-[2-methoxy-1-(2-methylpyrazol-3-yl)ethyl]-2-(tetrazol-1-yl)acetamide?
The canonical SMILES for N-[2-methoxy-1-(2-methylpyrazol-3-yl)ethyl]-2-(tetrazol-1-yl)acetamide is COCC(NC(=O)Cn1cnnn1)c1ccnn1C.
What is the InChIKey of N-[2-methoxy-1-(2-methylpyrazol-3-yl)ethyl]-2-(tetrazol-1-yl)acetamide?
The InChIKey is XJZVOHRRDGPUFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N7O2/c1-16-9(3-4-12-16)8(6-19-2)13-10(18)5-17-7-11-14-15-17/h3-4,7-8H,5-6H2,1-2H3,(H,13,18).
What are the key properties of N-[2-methoxy-1-(2-methylpyrazol-3-yl)ethyl]-2-(tetrazol-1-yl)acetamide?
N-[2-methoxy-1-(2-methylpyrazol-3-yl)ethyl]-2-(tetrazol-1-yl)acetamide has a molecular weight of 265.28 g/mol, XLogP of -1.09, 6 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methoxy-1-(2-methylpyrazol-3-yl)ethyl]-2-(tetrazol-1-yl)acetamide is sourced from PubChem (CID 91795894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).