N-(1,5-dimethylpyrazol-3-yl)-2-[1-(tetrazol-1-ylmethyl)cyclohexyl]acetamide

C15H23N7O — CID 71706581

IUPACN-(1,5-dimethylpyrazol-3-yl)-2-[1-(tetrazol-1-ylmethyl)cyclohexyl]acetamide
SMILESCc1cc(NC(=O)CC2(Cn3cnnn3)CCCCC2)nn1C
InChIInChI=1S/C15H23N7O/c1-12-8-13(18-21(12)2)17-14(23)9-15(6-4-3-5-7-15)10-22-11-16-19-20-22/h8,11H,3-7,9-10H2,1-2H3,(H,17,18,23)
InChIKeyUTOOWNYXIXHQBS-UHFFFAOYSA-N
MW317.40 g/mol
LogP1.69
Rot. Bonds5

About N-(1,5-dimethylpyrazol-3-yl)-2-[1-(tetrazol-1-ylmethyl)cyclohexyl]acetamide

N-(1,5-dimethylpyrazol-3-yl)-2-[1-(tetrazol-1-ylmethyl)cyclohexyl]acetamide (PubChem CID 71706581) has the molecular formula C15H23N7O and a molecular weight of 317.40 g/mol. Its IUPAC name is N-(1,5-dimethylpyrazol-3-yl)-2-[1-(tetrazol-1-ylmethyl)cyclohexyl]acetamide.

Molecular Properties

Compound NameN-(1,5-dimethylpyrazol-3-yl)-2-[1-(tetrazol-1-ylmethyl)cyclohexyl]acetamide
PubChem CID71706581
Molecular FormulaC15H23N7O
Molecular Weight317.40 g/mol
Exact Mass317.20
IUPAC NameN-(1,5-dimethylpyrazol-3-yl)-2-[1-(tetrazol-1-ylmethyl)cyclohexyl]acetamide
SMILESCc1cc(NC(=O)CC2(Cn3cnnn3)CCCCC2)nn1C
InChIInChI=1S/C15H23N7O/c1-12-8-13(18-21(12)2)17-14(23)9-15(6-4-3-5-7-15)10-22-11-16-19-20-22/h8,11H,3-7,9-10H2,1-2H3,(H,17,18,23)
InChIKeyUTOOWNYXIXHQBS-UHFFFAOYSA-N
XLogP1.69
TPSA90.52 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.40
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-(1,5-dimethylpyrazol-3-yl)-2-[1-(tetrazol-1-ylmethyl)cyclohexyl]acetamide?
The IUPAC name of N-(1,5-dimethylpyrazol-3-yl)-2-[1-(tetrazol-1-ylmethyl)cyclohexyl]acetamide (CID 71706581) is N-(1,5-dimethylpyrazol-3-yl)-2-[1-(tetrazol-1-ylmethyl)cyclohexyl]acetamide.
What is the SMILES notation for N-(1,5-dimethylpyrazol-3-yl)-2-[1-(tetrazol-1-ylmethyl)cyclohexyl]acetamide?
The canonical SMILES for N-(1,5-dimethylpyrazol-3-yl)-2-[1-(tetrazol-1-ylmethyl)cyclohexyl]acetamide is Cc1cc(NC(=O)CC2(Cn3cnnn3)CCCCC2)nn1C.
What is the InChIKey of N-(1,5-dimethylpyrazol-3-yl)-2-[1-(tetrazol-1-ylmethyl)cyclohexyl]acetamide?
The InChIKey is UTOOWNYXIXHQBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N7O/c1-12-8-13(18-21(12)2)17-14(23)9-15(6-4-3-5-7-15)10-22-11-16-19-20-22/h8,11H,3-7,9-10H2,1-2H3,(H,17,18,23).
What are the key properties of N-(1,5-dimethylpyrazol-3-yl)-2-[1-(tetrazol-1-ylmethyl)cyclohexyl]acetamide?
N-(1,5-dimethylpyrazol-3-yl)-2-[1-(tetrazol-1-ylmethyl)cyclohexyl]acetamide has a molecular weight of 317.40 g/mol, XLogP of 1.69, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,5-dimethylpyrazol-3-yl)-2-[1-(tetrazol-1-ylmethyl)cyclohexyl]acetamide is sourced from PubChem (CID 71706581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).