2-hydroxy-N-(8-propan-2-yloxyoctyl)acetamide;vanadium

C13H27NO3V — CID 154671854

IUPAC2-hydroxy-N-(8-propan-2-yloxyoctyl)acetamide;vanadium
SMILESCC(C)OCCCCCCCCNC(=O)CO.[V]
InChIInChI=1S/C13H27NO3.V/c1-12(2)17-10-8-6-4-3-5-7-9-14-13(16)11-15;/h12,15H,3-11H2,1-2H3,(H,14,16);
InChIKeyVIQJOOOZSRCSCB-UHFFFAOYSA-N
MW296.31 g/mol
LogP1.86
Rot. Bonds11

About 2-hydroxy-N-(8-propan-2-yloxyoctyl)acetamide;vanadium

2-hydroxy-N-(8-propan-2-yloxyoctyl)acetamide;vanadium (PubChem CID 154671854) has the molecular formula C13H27NO3V and a molecular weight of 296.31 g/mol. Its IUPAC name is 2-hydroxy-N-(8-propan-2-yloxyoctyl)acetamide;vanadium.

Molecular Properties

Compound Name2-hydroxy-N-(8-propan-2-yloxyoctyl)acetamide;vanadium
PubChem CID154671854
Molecular FormulaC13H27NO3V
Molecular Weight296.31 g/mol
Exact Mass296.14
IUPAC Name2-hydroxy-N-(8-propan-2-yloxyoctyl)acetamide;vanadium
SMILESCC(C)OCCCCCCCCNC(=O)CO.[V]
InChIInChI=1S/C13H27NO3.V/c1-12(2)17-10-8-6-4-3-5-7-9-14-13(16)11-15;/h12,15H,3-11H2,1-2H3,(H,14,16);
InChIKeyVIQJOOOZSRCSCB-UHFFFAOYSA-N
XLogP1.86
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.31
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-chloro-N-(4-propan-2-yloxybutyl)acetamide
CID 82109645
6-propan-2-yloxyhexylcarbamic acid
CID 126658630
N-[2-oxo-2-(4-propan-2-yloxybutylamino)ethyl]-6-propan-2-yloxyhexanamide
CID 166698453
N-heptyl-N'-(3-propan-2-yloxypropyl)butanediamide
CID 4554473
2-hydroxy-N-[7-[(2-hydroxyacetyl)amino]heptyl]acetamide
CID 119089107
6-methyl-4-oxo-N-(6-propan-2-yloxyhexyl)heptanamide
CID 163940607
2-[2-oxo-2-(4-propan-2-yloxybutylamino)ethoxy]acetic acid
CID 106003646
N-[4-(methylamino)butyl]-4-propan-2-yloxybutanamide
CID 162749933
3-(ethylamino)-N-(4-propan-2-yloxybutyl)butanamide
CID 106011222
2-hydroxy-N-(7-methyloctyl)acetamide
CID 134467211
(2R)-2-amino-3-methyl-N-(4-propan-2-yloxybutyl)butanamide
CID 106011533
N-(4-propan-2-yloxybutyl)acetamide;N-(2-propan-2-yloxyethyl)acetamide;N-(3-propan-2-yloxypropyl)acetamide
CID 158348499

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-(8-propan-2-yloxyoctyl)acetamide;vanadium?
The IUPAC name of 2-hydroxy-N-(8-propan-2-yloxyoctyl)acetamide;vanadium (CID 154671854) is 2-hydroxy-N-(8-propan-2-yloxyoctyl)acetamide;vanadium.
What is the SMILES notation for 2-hydroxy-N-(8-propan-2-yloxyoctyl)acetamide;vanadium?
The canonical SMILES for 2-hydroxy-N-(8-propan-2-yloxyoctyl)acetamide;vanadium is CC(C)OCCCCCCCCNC(=O)CO.[V].
What is the InChIKey of 2-hydroxy-N-(8-propan-2-yloxyoctyl)acetamide;vanadium?
The InChIKey is VIQJOOOZSRCSCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27NO3.V/c1-12(2)17-10-8-6-4-3-5-7-9-14-13(16)11-15;/h12,15H,3-11H2,1-2H3,(H,14,16);.
What are the key properties of 2-hydroxy-N-(8-propan-2-yloxyoctyl)acetamide;vanadium?
2-hydroxy-N-(8-propan-2-yloxyoctyl)acetamide;vanadium has a molecular weight of 296.31 g/mol, XLogP of 1.86, 11 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-(8-propan-2-yloxyoctyl)acetamide;vanadium is sourced from PubChem (CID 154671854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).