ethane;3-hydroxy-N,5-dimethylhexanamide;vanadium

C10H23NO2V — CID 177155626

IUPACethane;3-hydroxy-N,5-dimethylhexanamide;vanadium
SMILESCC.CNC(=O)CC(O)CC(C)C.[V]
InChIInChI=1S/C8H17NO2.C2H6.V/c1-6(2)4-7(10)5-8(11)9-3;1-2;/h6-7,10H,4-5H2,1-3H3,(H,9,11);1-2H3;
InChIKeyIOBNYUYJZOSDSW-UHFFFAOYSA-N
MW240.24 g/mol
LogP1.55
Rot. Bonds4

About ethane;3-hydroxy-N,5-dimethylhexanamide;vanadium

ethane;3-hydroxy-N,5-dimethylhexanamide;vanadium (PubChem CID 177155626) has the molecular formula C10H23NO2V and a molecular weight of 240.24 g/mol. Its IUPAC name is ethane;3-hydroxy-N,5-dimethylhexanamide;vanadium.

Molecular Properties

Compound Nameethane;3-hydroxy-N,5-dimethylhexanamide;vanadium
PubChem CID177155626
Molecular FormulaC10H23NO2V
Molecular Weight240.24 g/mol
Exact Mass240.12
IUPAC Nameethane;3-hydroxy-N,5-dimethylhexanamide;vanadium
SMILESCC.CNC(=O)CC(O)CC(C)C.[V]
InChIInChI=1S/C8H17NO2.C2H6.V/c1-6(2)4-7(10)5-8(11)9-3;1-2;/h6-7,10H,4-5H2,1-3H3,(H,9,11);1-2H3;
InChIKeyIOBNYUYJZOSDSW-UHFFFAOYSA-N
XLogP1.55
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.24
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

ethane;3-ethyl-N,5-dimethylhexanamide
CID 177048526
methyl (3R)-3-hydroxy-5-methylhexanoate
CID 10920813
(3R)-3-acetamido-N-methylbutanamide
CID 87931486
(3R)-3-amino-N-methylbutanamide;hydrochloride
CID 87931451
N-methyl-3-(4-methylhexan-2-ylamino)butanamide
CID 115892025
(3S)-3-acetamido-N-[(2S)-4-[[(2S)-4-[[(2S)-4-[[(2S)-4-[[(2S)-4-(methylamino)-4-oxobutan-2-yl]amino]-4-oxobutan-2-yl]amino]-4-oxobutan-2-yl]amino]-4-oxobutan-2-yl]amino]-4-oxobutan-2-yl]butanamide
CID 101104049
(3S)-N-methyl-3-methylsulfanylbutanamide
CID 58528328
(4R,6R)-2,8-dimethylnonane-4,6-diol
CID 15640449
3-methylbutan-2-yl 3-hydroxy-5-methylhexanoate
CID 137457836
3-(2-methoxypropyl)-N,N'-dimethylpentanediamide
CID 141238561
ethane;4-(methylamino)-4-oxo-2-sulfanylbutanoic acid
CID 170596842
ethane;N,N',2,2,4-pentamethylhexanediamide
CID 156649253

Frequently Asked Questions

What is the IUPAC name of ethane;3-hydroxy-N,5-dimethylhexanamide;vanadium?
The IUPAC name of ethane;3-hydroxy-N,5-dimethylhexanamide;vanadium (CID 177155626) is ethane;3-hydroxy-N,5-dimethylhexanamide;vanadium.
What is the SMILES notation for ethane;3-hydroxy-N,5-dimethylhexanamide;vanadium?
The canonical SMILES for ethane;3-hydroxy-N,5-dimethylhexanamide;vanadium is CC.CNC(=O)CC(O)CC(C)C.[V].
What is the InChIKey of ethane;3-hydroxy-N,5-dimethylhexanamide;vanadium?
The InChIKey is IOBNYUYJZOSDSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO2.C2H6.V/c1-6(2)4-7(10)5-8(11)9-3;1-2;/h6-7,10H,4-5H2,1-3H3,(H,9,11);1-2H3;.
What are the key properties of ethane;3-hydroxy-N,5-dimethylhexanamide;vanadium?
ethane;3-hydroxy-N,5-dimethylhexanamide;vanadium has a molecular weight of 240.24 g/mol, XLogP of 1.55, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;3-hydroxy-N,5-dimethylhexanamide;vanadium is sourced from PubChem (CID 177155626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).