methane;1-propan-2-ylpyrazole;2-propan-2-ylpyridine;yttrium

C17H33N3Y — CID 161379957

IUPACmethane;1-propan-2-ylpyrazole;2-propan-2-ylpyridine;yttrium
SMILESC.C.C.CC(C)c1ccccn1.CC(C)n1cccn1.[Y]
InChIInChI=1S/C8H11N.C6H10N2.3CH4.Y/c1-7(2)8-5-3-4-6-9-8;1-6(2)8-5-3-4-7-8;;;;/h3-7H,1-2H3;3-6H,1-2H3;3*1H4;
InChIKeyVROZWLNMFLZGGM-UHFFFAOYSA-N
MW368.38 g/mol
LogP5.57
Rot. Bonds2

About methane;1-propan-2-ylpyrazole;2-propan-2-ylpyridine;yttrium

methane;1-propan-2-ylpyrazole;2-propan-2-ylpyridine;yttrium (PubChem CID 161379957) has the molecular formula C17H33N3Y and a molecular weight of 368.38 g/mol. Its IUPAC name is methane;1-propan-2-ylpyrazole;2-propan-2-ylpyridine;yttrium.

Molecular Properties

Compound Namemethane;1-propan-2-ylpyrazole;2-propan-2-ylpyridine;yttrium
PubChem CID161379957
Molecular FormulaC17H33N3Y
Molecular Weight368.38 g/mol
Exact Mass368.17
IUPAC Namemethane;1-propan-2-ylpyrazole;2-propan-2-ylpyridine;yttrium
SMILESC.C.C.CC(C)c1ccccn1.CC(C)n1cccn1.[Y]
InChIInChI=1S/C8H11N.C6H10N2.3CH4.Y/c1-7(2)8-5-3-4-6-9-8;1-6(2)8-5-3-4-7-8;;;;/h3-7H,1-2H3;3-6H,1-2H3;3*1H4;
InChIKeyVROZWLNMFLZGGM-UHFFFAOYSA-N
XLogP5.57
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500368.38
LogP ≤ 55.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

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1-methylpiperidine;2-propan-2-ylpyridine
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2,4-dipyridin-2-ylpentan-3-one
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CID 159031608
bis(2-propan-2-ylpyridine);bis(3-propan-2-ylpyridine)
CID 158875666
2-[(2R)-3-methylbutan-2-yl]pyridine
CID 26793118
N-[(1R)-1-pyridin-2-ylethyl]hydroxylamine
CID 51441798
5-propan-2-yl-1,2,4-oxadiazole;2-propan-2-ylpyridine
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ethane;2-propan-2-ylpyridine;6-propan-2-yl-3H-pyridin-3-ide;rhenium
CID 164573338

Frequently Asked Questions

What is the IUPAC name of methane;1-propan-2-ylpyrazole;2-propan-2-ylpyridine;yttrium?
The IUPAC name of methane;1-propan-2-ylpyrazole;2-propan-2-ylpyridine;yttrium (CID 161379957) is methane;1-propan-2-ylpyrazole;2-propan-2-ylpyridine;yttrium.
What is the SMILES notation for methane;1-propan-2-ylpyrazole;2-propan-2-ylpyridine;yttrium?
The canonical SMILES for methane;1-propan-2-ylpyrazole;2-propan-2-ylpyridine;yttrium is C.C.C.CC(C)c1ccccn1.CC(C)n1cccn1.[Y].
What is the InChIKey of methane;1-propan-2-ylpyrazole;2-propan-2-ylpyridine;yttrium?
The InChIKey is VROZWLNMFLZGGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N.C6H10N2.3CH4.Y/c1-7(2)8-5-3-4-6-9-8;1-6(2)8-5-3-4-7-8;;;;/h3-7H,1-2H3;3-6H,1-2H3;3*1H4;.
What are the key properties of methane;1-propan-2-ylpyrazole;2-propan-2-ylpyridine;yttrium?
methane;1-propan-2-ylpyrazole;2-propan-2-ylpyridine;yttrium has a molecular weight of 368.38 g/mol, XLogP of 5.57, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methane;1-propan-2-ylpyrazole;2-propan-2-ylpyridine;yttrium is sourced from PubChem (CID 161379957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).