argon;3,4-dimethylhexane;3,5-dimethyl-4H-pyrazole

C13H26Ar2N2 — CID 157147348

IUPACargon;3,4-dimethylhexane;3,5-dimethyl-4H-pyrazole
SMILESCC1=NN=C(C)C1.CCC(C)C(C)CC.[Ar].[Ar]
InChIInChI=1S/C8H18.C5H8N2.2Ar/c1-5-7(3)8(4)6-2;1-4-3-5(2)7-6-4;;/h7-8H,5-6H2,1-4H3;3H2,1-2H3;;
InChIKeyAKVYQXDBNJWNQS-UHFFFAOYSA-N
MW290.26 g/mol
LogP4.31
Rot. Bonds3

About argon;3,4-dimethylhexane;3,5-dimethyl-4H-pyrazole

argon;3,4-dimethylhexane;3,5-dimethyl-4H-pyrazole (PubChem CID 157147348) has the molecular formula C13H26Ar2N2 and a molecular weight of 290.26 g/mol. Its IUPAC name is argon;3,4-dimethylhexane;3,5-dimethyl-4H-pyrazole.

Molecular Properties

Compound Nameargon;3,4-dimethylhexane;3,5-dimethyl-4H-pyrazole
PubChem CID157147348
Molecular FormulaC13H26Ar2N2
Molecular Weight290.26 g/mol
Exact Mass290.13
IUPAC Nameargon;3,4-dimethylhexane;3,5-dimethyl-4H-pyrazole
SMILESCC1=NN=C(C)C1.CCC(C)C(C)CC.[Ar].[Ar]
InChIInChI=1S/C8H18.C5H8N2.2Ar/c1-5-7(3)8(4)6-2;1-4-3-5(2)7-6-4;;/h7-8H,5-6H2,1-4H3;3H2,1-2H3;;
InChIKeyAKVYQXDBNJWNQS-UHFFFAOYSA-N
XLogP4.31
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.26
LogP ≤ 54.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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3-chloro-5-methyl-4H-pyrazole
CID 98452102
1-butan-2-yl-2-methylcyclopropene
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(4R)-3-ethyl-4-methylhexane
CID 59954491
(3R)-3,4-dimethylheptane
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CID 91405313
3-methyl-1-methylsulfanylpentan-2-ol
CID 79444760
butane;3-methyl-5-phenyl-4H-pyrazole
CID 91042720
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Frequently Asked Questions

What is the IUPAC name of argon;3,4-dimethylhexane;3,5-dimethyl-4H-pyrazole?
The IUPAC name of argon;3,4-dimethylhexane;3,5-dimethyl-4H-pyrazole (CID 157147348) is argon;3,4-dimethylhexane;3,5-dimethyl-4H-pyrazole.
What is the SMILES notation for argon;3,4-dimethylhexane;3,5-dimethyl-4H-pyrazole?
The canonical SMILES for argon;3,4-dimethylhexane;3,5-dimethyl-4H-pyrazole is CC1=NN=C(C)C1.CCC(C)C(C)CC.[Ar].[Ar].
What is the InChIKey of argon;3,4-dimethylhexane;3,5-dimethyl-4H-pyrazole?
The InChIKey is AKVYQXDBNJWNQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18.C5H8N2.2Ar/c1-5-7(3)8(4)6-2;1-4-3-5(2)7-6-4;;/h7-8H,5-6H2,1-4H3;3H2,1-2H3;;.
What are the key properties of argon;3,4-dimethylhexane;3,5-dimethyl-4H-pyrazole?
argon;3,4-dimethylhexane;3,5-dimethyl-4H-pyrazole has a molecular weight of 290.26 g/mol, XLogP of 4.31, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for argon;3,4-dimethylhexane;3,5-dimethyl-4H-pyrazole is sourced from PubChem (CID 157147348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).