2-(1,5-dimethylpyrazol-4-yl)cyclopropan-1-amine;dihydrochloride

C8H15Cl2N3 — CID 122198975

IUPAC2-(1,5-dimethylpyrazol-4-yl)cyclopropan-1-amine;dihydrochloride
SMILESCc1c(C2CC2N)cnn1C.Cl.Cl
InChIInChI=1S/C8H13N3.2ClH/c1-5-7(4-10-11(5)2)6-3-8(6)9;;/h4,6,8H,3,9H2,1-2H3;2*1H
InChIKeyZHPOGLWAEFJKLC-UHFFFAOYSA-N
MW224.14 g/mol
LogP1.39
Rot. Bonds1

About 2-(1,5-dimethylpyrazol-4-yl)cyclopropan-1-amine;dihydrochloride

2-(1,5-dimethylpyrazol-4-yl)cyclopropan-1-amine;dihydrochloride (PubChem CID 122198975) has the molecular formula C8H15Cl2N3 and a molecular weight of 224.14 g/mol. Its IUPAC name is 2-(1,5-dimethylpyrazol-4-yl)cyclopropan-1-amine;dihydrochloride.

Molecular Properties

Compound Name2-(1,5-dimethylpyrazol-4-yl)cyclopropan-1-amine;dihydrochloride
PubChem CID122198975
Molecular FormulaC8H15Cl2N3
Molecular Weight224.14 g/mol
Exact Mass223.06
IUPAC Name2-(1,5-dimethylpyrazol-4-yl)cyclopropan-1-amine;dihydrochloride
SMILESCc1c(C2CC2N)cnn1C.Cl.Cl
InChIInChI=1S/C8H13N3.2ClH/c1-5-7(4-10-11(5)2)6-3-8(6)9;;/h4,6,8H,3,9H2,1-2H3;2*1H
InChIKeyZHPOGLWAEFJKLC-UHFFFAOYSA-N
XLogP1.39
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.14
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(1,5-dimethylpyrazol-4-yl)cyclopropan-1-amine;dihydrochloride?
The IUPAC name of 2-(1,5-dimethylpyrazol-4-yl)cyclopropan-1-amine;dihydrochloride (CID 122198975) is 2-(1,5-dimethylpyrazol-4-yl)cyclopropan-1-amine;dihydrochloride.
What is the SMILES notation for 2-(1,5-dimethylpyrazol-4-yl)cyclopropan-1-amine;dihydrochloride?
The canonical SMILES for 2-(1,5-dimethylpyrazol-4-yl)cyclopropan-1-amine;dihydrochloride is Cc1c(C2CC2N)cnn1C.Cl.Cl.
What is the InChIKey of 2-(1,5-dimethylpyrazol-4-yl)cyclopropan-1-amine;dihydrochloride?
The InChIKey is ZHPOGLWAEFJKLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3.2ClH/c1-5-7(4-10-11(5)2)6-3-8(6)9;;/h4,6,8H,3,9H2,1-2H3;2*1H.
What are the key properties of 2-(1,5-dimethylpyrazol-4-yl)cyclopropan-1-amine;dihydrochloride?
2-(1,5-dimethylpyrazol-4-yl)cyclopropan-1-amine;dihydrochloride has a molecular weight of 224.14 g/mol, XLogP of 1.39, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,5-dimethylpyrazol-4-yl)cyclopropan-1-amine;dihydrochloride is sourced from PubChem (CID 122198975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).