potassium;hydride;2-methylpentanal

C6H13KO — CID 173401246

IUPACpotassium;hydride;2-methylpentanal
SMILESCCCC(C)C=O.[H-].[K+]
InChIInChI=1S/C6H12O.K.H/c1-3-4-6(2)5-7;;/h5-6H,3-4H2,1-2H3;;/q;+1;-1
InChIKeyRLYDKPAQFZVDBE-UHFFFAOYSA-N
MW140.27 g/mol
LogP-1.26
Rot. Bonds3

About potassium;hydride;2-methylpentanal

potassium;hydride;2-methylpentanal (PubChem CID 173401246) has the molecular formula C6H13KO and a molecular weight of 140.27 g/mol. Its IUPAC name is potassium;hydride;2-methylpentanal.

Molecular Properties

Compound Namepotassium;hydride;2-methylpentanal
PubChem CID173401246
Molecular FormulaC6H13KO
Molecular Weight140.27 g/mol
Exact Mass140.06
IUPAC Namepotassium;hydride;2-methylpentanal
SMILESCCCC(C)C=O.[H-].[K+]
InChIInChI=1S/C6H12O.K.H/c1-3-4-6(2)5-7;;/h5-6H,3-4H2,1-2H3;;/q;+1;-1
InChIKeyRLYDKPAQFZVDBE-UHFFFAOYSA-N
XLogP-1.26
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.27
LogP ≤ 5-1.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

2-methylpentanal;propanal
CID 23460116
magnesium;hydride;2-methylhexanal
CID 175489752
2-methylpentanal;(2S)-2-methylpentanal;(2R)-2-methylpentan-1-ol;sulfane
CID 169429649
N,2-dimethylpropan-2-amine;2-methylpentanal
CID 153346269
2-methyldodecanal
CID 87784106
2-methylpentanal;phenol
CID 174274492
(2R,4R,6R,8R)-2,4,6,8-tetramethylundecanal
CID 10900342
2-methyl-5-oxooctanal
CID 155026119
1-methyltricosane-1,6,12,19-tetracarbaldehyde
CID 174477373
(2S,6S,10S,14S)-2,6,10,14-tetramethylhenicosanal
CID 139263692
2,6-dimethylhept-5-enal
CID 158364508
2,5-dimethylhept-6-enal
CID 88788284

Frequently Asked Questions

What is the IUPAC name of potassium;hydride;2-methylpentanal?
The IUPAC name of potassium;hydride;2-methylpentanal (CID 173401246) is potassium;hydride;2-methylpentanal.
What is the SMILES notation for potassium;hydride;2-methylpentanal?
The canonical SMILES for potassium;hydride;2-methylpentanal is CCCC(C)C=O.[H-].[K+].
What is the InChIKey of potassium;hydride;2-methylpentanal?
The InChIKey is RLYDKPAQFZVDBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12O.K.H/c1-3-4-6(2)5-7;;/h5-6H,3-4H2,1-2H3;;/q;+1;-1.
What are the key properties of potassium;hydride;2-methylpentanal?
potassium;hydride;2-methylpentanal has a molecular weight of 140.27 g/mol, XLogP of -1.26, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;hydride;2-methylpentanal is sourced from PubChem (CID 173401246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).