1,3-dimethyl-5-pyridin-3-yloxypyrazol-4-amine;dihydrochloride

C10H14Cl2N4O — CID 47003325

IUPAC1,3-dimethyl-5-pyridin-3-yloxypyrazol-4-amine;dihydrochloride
SMILESCc1nn(C)c(Oc2cccnc2)c1N.Cl.Cl
InChIInChI=1S/C10H12N4O.2ClH/c1-7-9(11)10(14(2)13-7)15-8-4-3-5-12-6-8;;/h3-6H,11H2,1-2H3;2*1H
InChIKeyUIAFNPGZBLVBER-UHFFFAOYSA-N
MW277.15 g/mol
LogP2.34
Rot. Bonds2

About 1,3-dimethyl-5-pyridin-3-yloxypyrazol-4-amine;dihydrochloride

1,3-dimethyl-5-pyridin-3-yloxypyrazol-4-amine;dihydrochloride (PubChem CID 47003325) has the molecular formula C10H14Cl2N4O and a molecular weight of 277.15 g/mol. Its IUPAC name is 1,3-dimethyl-5-pyridin-3-yloxypyrazol-4-amine;dihydrochloride.

Molecular Properties

Compound Name1,3-dimethyl-5-pyridin-3-yloxypyrazol-4-amine;dihydrochloride
PubChem CID47003325
Molecular FormulaC10H14Cl2N4O
Molecular Weight277.15 g/mol
Exact Mass276.05
IUPAC Name1,3-dimethyl-5-pyridin-3-yloxypyrazol-4-amine;dihydrochloride
SMILESCc1nn(C)c(Oc2cccnc2)c1N.Cl.Cl
InChIInChI=1S/C10H12N4O.2ClH/c1-7-9(11)10(14(2)13-7)15-8-4-3-5-12-6-8;;/h3-6H,11H2,1-2H3;2*1H
InChIKeyUIAFNPGZBLVBER-UHFFFAOYSA-N
XLogP2.34
TPSA65.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.15
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1,3-dimethyl-5-pyridin-3-yloxypyrazol-4-amine;dihydrochloride?
The IUPAC name of 1,3-dimethyl-5-pyridin-3-yloxypyrazol-4-amine;dihydrochloride (CID 47003325) is 1,3-dimethyl-5-pyridin-3-yloxypyrazol-4-amine;dihydrochloride.
What is the SMILES notation for 1,3-dimethyl-5-pyridin-3-yloxypyrazol-4-amine;dihydrochloride?
The canonical SMILES for 1,3-dimethyl-5-pyridin-3-yloxypyrazol-4-amine;dihydrochloride is Cc1nn(C)c(Oc2cccnc2)c1N.Cl.Cl.
What is the InChIKey of 1,3-dimethyl-5-pyridin-3-yloxypyrazol-4-amine;dihydrochloride?
The InChIKey is UIAFNPGZBLVBER-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4O.2ClH/c1-7-9(11)10(14(2)13-7)15-8-4-3-5-12-6-8;;/h3-6H,11H2,1-2H3;2*1H.
What are the key properties of 1,3-dimethyl-5-pyridin-3-yloxypyrazol-4-amine;dihydrochloride?
1,3-dimethyl-5-pyridin-3-yloxypyrazol-4-amine;dihydrochloride has a molecular weight of 277.15 g/mol, XLogP of 2.34, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethyl-5-pyridin-3-yloxypyrazol-4-amine;dihydrochloride is sourced from PubChem (CID 47003325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).