methyl(3-oxobutan-2-yl)azanide;rubidium(1+)

C5H10NORb — CID 177242198

IUPACmethyl(3-oxobutan-2-yl)azanide;rubidium(1+)
SMILESC[N-]C(C)C(C)=O.[Rb+]
InChIInChI=1S/C5H10NO.Rb/c1-4(6-3)5(2)7;/h4H,1-3H3;/q-1;+1
InChIKeySEXZWUOEDUFBLO-UHFFFAOYSA-N
MW185.61 g/mol
LogP-2.03
Rot. Bonds2

About methyl(3-oxobutan-2-yl)azanide;rubidium(1+)

methyl(3-oxobutan-2-yl)azanide;rubidium(1+) (PubChem CID 177242198) has the molecular formula C5H10NORb and a molecular weight of 185.61 g/mol. Its IUPAC name is methyl(3-oxobutan-2-yl)azanide;rubidium(1+).

Molecular Properties

Compound Namemethyl(3-oxobutan-2-yl)azanide;rubidium(1+)
PubChem CID177242198
Molecular FormulaC5H10NORb
Molecular Weight185.61 g/mol
Exact Mass184.99
IUPAC Namemethyl(3-oxobutan-2-yl)azanide;rubidium(1+)
SMILESC[N-]C(C)C(C)=O.[Rb+]
InChIInChI=1S/C5H10NO.Rb/c1-4(6-3)5(2)7;/h4H,1-3H3;/q-1;+1
InChIKeySEXZWUOEDUFBLO-UHFFFAOYSA-N
XLogP-2.03
TPSA31.17 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.61
LogP ≤ 5-2.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

acetyl(methyl)azanide;rubidium(1+)
CID 59953041
lithium;hydride;3-methylbutan-2-one
CID 173095274
[(2S)-3-oxo(313C)butan-2-yl](15N)azanium
CID 167635935
(3R)-3-fluorobutan-2-one
CID 638120
3-propan-2-ylsulfinylbutan-2-one
CID 64638745
(3S)-3-hydroxybutan-2-one;3-methylbutan-2-one
CID 161241021
carbanide;[1-(1-carboxypropan-2-ylamino)-1-oxopropan-2-yl]-methylazanide;yttrium
CID 59971091
3,4-dimethylpentan-2-one;sulfane
CID 158809949
deuterio(methyl)borinothioic acid;(3R)-3-tritiooxybutan-2-one
CID 161020430
methane;4-methyl-3-(methylamino)pentan-2-one
CID 158029280
propan-2-one;sulfur monoxide
CID 21387950
3-acetylpentane-2,4-dione;hafnium
CID 87389102

Frequently Asked Questions

What is the IUPAC name of methyl(3-oxobutan-2-yl)azanide;rubidium(1+)?
The IUPAC name of methyl(3-oxobutan-2-yl)azanide;rubidium(1+) (CID 177242198) is methyl(3-oxobutan-2-yl)azanide;rubidium(1+).
What is the SMILES notation for methyl(3-oxobutan-2-yl)azanide;rubidium(1+)?
The canonical SMILES for methyl(3-oxobutan-2-yl)azanide;rubidium(1+) is C[N-]C(C)C(C)=O.[Rb+].
What is the InChIKey of methyl(3-oxobutan-2-yl)azanide;rubidium(1+)?
The InChIKey is SEXZWUOEDUFBLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10NO.Rb/c1-4(6-3)5(2)7;/h4H,1-3H3;/q-1;+1.
What are the key properties of methyl(3-oxobutan-2-yl)azanide;rubidium(1+)?
methyl(3-oxobutan-2-yl)azanide;rubidium(1+) has a molecular weight of 185.61 g/mol, XLogP of -2.03, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for methyl(3-oxobutan-2-yl)azanide;rubidium(1+) is sourced from PubChem (CID 177242198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).