1-(5-amino-1H-pyrazol-4-yl)-2-(2-methyltetrazol-5-yl)ethanol

C7H11N7O — CID 107047855

IUPAC1-(5-amino-1H-pyrazol-4-yl)-2-(2-methyltetrazol-5-yl)ethanol
SMILESCn1nnc(CC(O)c2cn[nH]c2N)n1
InChIInChI=1S/C7H11N7O/c1-14-12-6(10-13-14)2-5(15)4-3-9-11-7(4)8/h3,5,15H,2H2,1H3,(H3,8,9,11)
InChIKeyKQDUEBDPYGZPCK-UHFFFAOYSA-N
MW209.21 g/mol
LogP-1.21
Rot. Bonds3

About 1-(5-amino-1H-pyrazol-4-yl)-2-(2-methyltetrazol-5-yl)ethanol

1-(5-amino-1H-pyrazol-4-yl)-2-(2-methyltetrazol-5-yl)ethanol (PubChem CID 107047855) has the molecular formula C7H11N7O and a molecular weight of 209.21 g/mol. Its IUPAC name is 1-(5-amino-1H-pyrazol-4-yl)-2-(2-methyltetrazol-5-yl)ethanol.

Molecular Properties

Compound Name1-(5-amino-1H-pyrazol-4-yl)-2-(2-methyltetrazol-5-yl)ethanol
PubChem CID107047855
Molecular FormulaC7H11N7O
Molecular Weight209.21 g/mol
Exact Mass209.10
IUPAC Name1-(5-amino-1H-pyrazol-4-yl)-2-(2-methyltetrazol-5-yl)ethanol
SMILESCn1nnc(CC(O)c2cn[nH]c2N)n1
InChIInChI=1S/C7H11N7O/c1-14-12-6(10-13-14)2-5(15)4-3-9-11-7(4)8/h3,5,15H,2H2,1H3,(H3,8,9,11)
InChIKeyKQDUEBDPYGZPCK-UHFFFAOYSA-N
XLogP-1.21
TPSA118.53 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.21
LogP ≤ 5-1.21
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 1-(5-amino-1H-pyrazol-4-yl)-2-(2-methyltetrazol-5-yl)ethanol?
The IUPAC name of 1-(5-amino-1H-pyrazol-4-yl)-2-(2-methyltetrazol-5-yl)ethanol (CID 107047855) is 1-(5-amino-1H-pyrazol-4-yl)-2-(2-methyltetrazol-5-yl)ethanol.
What is the SMILES notation for 1-(5-amino-1H-pyrazol-4-yl)-2-(2-methyltetrazol-5-yl)ethanol?
The canonical SMILES for 1-(5-amino-1H-pyrazol-4-yl)-2-(2-methyltetrazol-5-yl)ethanol is Cn1nnc(CC(O)c2cn[nH]c2N)n1.
What is the InChIKey of 1-(5-amino-1H-pyrazol-4-yl)-2-(2-methyltetrazol-5-yl)ethanol?
The InChIKey is KQDUEBDPYGZPCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N7O/c1-14-12-6(10-13-14)2-5(15)4-3-9-11-7(4)8/h3,5,15H,2H2,1H3,(H3,8,9,11).
What are the key properties of 1-(5-amino-1H-pyrazol-4-yl)-2-(2-methyltetrazol-5-yl)ethanol?
1-(5-amino-1H-pyrazol-4-yl)-2-(2-methyltetrazol-5-yl)ethanol has a molecular weight of 209.21 g/mol, XLogP of -1.21, 3 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-amino-1H-pyrazol-4-yl)-2-(2-methyltetrazol-5-yl)ethanol is sourced from PubChem (CID 107047855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).