1-methylpyrazole;platinum(2+);propan-2-amine;diacetate

C11H21N3O4Pt — CID 11641044

IUPAC1-methylpyrazole;platinum(2+);propan-2-amine;diacetate
SMILESCC(=O)[O-].CC(=O)[O-].CC(C)N.Cn1cccn1.[Pt+2]
InChIInChI=1S/C4H6N2.C3H9N.2C2H4O2.Pt/c1-6-4-2-3-5-6;1-3(2)4;2*1-2(3)4;/h2-4H,1H3;3H,4H2,1-2H3;2*1H3,(H,3,4);/q;;;;+2/p-2
InChIKeyWTRFAKOPVQTEKP-UHFFFAOYSA-L
MW454.38 g/mol
LogP-1.72
Rot. Bonds

About 1-methylpyrazole;platinum(2+);propan-2-amine;diacetate

1-methylpyrazole;platinum(2+);propan-2-amine;diacetate (PubChem CID 11641044) has the molecular formula C11H21N3O4Pt and a molecular weight of 454.38 g/mol. Its IUPAC name is 1-methylpyrazole;platinum(2+);propan-2-amine;diacetate.

Molecular Properties

Compound Name1-methylpyrazole;platinum(2+);propan-2-amine;diacetate
PubChem CID11641044
Molecular FormulaC11H21N3O4Pt
Molecular Weight454.38 g/mol
Exact Mass454.12
IUPAC Name1-methylpyrazole;platinum(2+);propan-2-amine;diacetate
SMILESCC(=O)[O-].CC(=O)[O-].CC(C)N.Cn1cccn1.[Pt+2]
InChIInChI=1S/C4H6N2.C3H9N.2C2H4O2.Pt/c1-6-4-2-3-5-6;1-3(2)4;2*1-2(3)4;/h2-4H,1H3;3H,4H2,1-2H3;2*1H3,(H,3,4);/q;;;;+2/p-2
InChIKeyWTRFAKOPVQTEKP-UHFFFAOYSA-L
XLogP-1.72
TPSA124.10 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500454.38
LogP ≤ 5-1.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

bis(1-methylpyrazole);ruthenium(3+)
CID 5123364
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CID 76503480
(2S)-2-pyrazol-1-ylpropanamide
CID 42576360
2-pyrazol-1-ylpropanamide
CID 25248322
1,1-dichloro-4-ethoxybut-3-en-2-one;1-methylpyrazole
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3-carbamoyl-1H-pyrazole-5-carboxylic acid;1-methylpyrazole
CID 69264149
4-pyrazol-1-ylpentan-2-one
CID 64696906
methyl (2R)-2-amino-2-pyrazol-1-ylacetate
CID 122173749
ethane;(3Z)-4-methylhexa-1,3-diene;1-methylpyrazole
CID 142385944
sodium;2-aminopropanoic acid;acetate
CID 159185216
methyl 2-(propan-2-ylamino)-4-pyrazol-1-ylbutanoate
CID 63040313

Frequently Asked Questions

What is the IUPAC name of 1-methylpyrazole;platinum(2+);propan-2-amine;diacetate?
The IUPAC name of 1-methylpyrazole;platinum(2+);propan-2-amine;diacetate (CID 11641044) is 1-methylpyrazole;platinum(2+);propan-2-amine;diacetate.
What is the SMILES notation for 1-methylpyrazole;platinum(2+);propan-2-amine;diacetate?
The canonical SMILES for 1-methylpyrazole;platinum(2+);propan-2-amine;diacetate is CC(=O)[O-].CC(=O)[O-].CC(C)N.Cn1cccn1.[Pt+2].
What is the InChIKey of 1-methylpyrazole;platinum(2+);propan-2-amine;diacetate?
The InChIKey is WTRFAKOPVQTEKP-UHFFFAOYSA-L. The full InChI is InChI=1S/C4H6N2.C3H9N.2C2H4O2.Pt/c1-6-4-2-3-5-6;1-3(2)4;2*1-2(3)4;/h2-4H,1H3;3H,4H2,1-2H3;2*1H3,(H,3,4);/q;;;;+2/p-2.
What are the key properties of 1-methylpyrazole;platinum(2+);propan-2-amine;diacetate?
1-methylpyrazole;platinum(2+);propan-2-amine;diacetate has a molecular weight of 454.38 g/mol, XLogP of -1.72, 0 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methylpyrazole;platinum(2+);propan-2-amine;diacetate is sourced from PubChem (CID 11641044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).