N-[4-(hydroxymethyl)cyclopent-2-en-1-yl]acetamide;vanadium

C8H13NO2V — CID 162196806

IUPACN-[4-(hydroxymethyl)cyclopent-2-en-1-yl]acetamide;vanadium
SMILESCC(=O)NC1C=CC(CO)C1.[V]
InChIInChI=1S/C8H13NO2.V/c1-6(11)9-8-3-2-7(4-8)5-10;/h2-3,7-8,10H,4-5H2,1H3,(H,9,11);
InChIKeyZRAXPMNJIPTTAK-UHFFFAOYSA-N
MW206.14 g/mol
LogP0.06
Rot. Bonds2

About N-[4-(hydroxymethyl)cyclopent-2-en-1-yl]acetamide;vanadium

N-[4-(hydroxymethyl)cyclopent-2-en-1-yl]acetamide;vanadium (PubChem CID 162196806) has the molecular formula C8H13NO2V and a molecular weight of 206.14 g/mol. Its IUPAC name is N-[4-(hydroxymethyl)cyclopent-2-en-1-yl]acetamide;vanadium.

Molecular Properties

Compound NameN-[4-(hydroxymethyl)cyclopent-2-en-1-yl]acetamide;vanadium
PubChem CID162196806
Molecular FormulaC8H13NO2V
Molecular Weight206.14 g/mol
Exact Mass206.04
IUPAC NameN-[4-(hydroxymethyl)cyclopent-2-en-1-yl]acetamide;vanadium
SMILESCC(=O)NC1C=CC(CO)C1.[V]
InChIInChI=1S/C8H13NO2.V/c1-6(11)9-8-3-2-7(4-8)5-10;/h2-3,7-8,10H,4-5H2,1H3,(H,9,11);
InChIKeyZRAXPMNJIPTTAK-UHFFFAOYSA-N
XLogP0.06
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.14
LogP ≤ 50.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[(1R,4S)-4-(hydroxymethyl)cyclopent-2-en-1-yl]acetamide
CID 10130076
[(1S,4R)-4-acetamidocyclopent-2-en-1-yl]methyl acetate
CID 10867271
N-[(1S,4R)-4-(hydroxymethyl)cyclopent-2-en-1-yl]-6-methylpyridine-3-carboxamide
CID 111661211
1-hexyl-3-[(1S,4R)-4-(hydroxymethyl)cyclopent-2-en-1-yl]urea
CID 111630279
1-(4,6-dimethyl-2-pyridinyl)-3-[(1S,4R)-4-(hydroxymethyl)cyclopent-2-en-1-yl]urea
CID 75523326
3-acetamido-N-[(1S,4R)-4-(hydroxymethyl)cyclopent-2-en-1-yl]-3-(4-methylphenyl)propanamide
CID 111661619
N-[(1S,4R)-4-(hydroxymethyl)cyclopent-2-en-1-yl]-2-(2-hydroxyphenyl)acetamide
CID 111661488
3-hydroxy-N-[(1S,4R)-4-(hydroxymethyl)cyclopent-2-en-1-yl]-5-methylbenzamide
CID 111696980
1-[(1S,4R)-4-(hydroxymethyl)cyclopent-2-en-1-yl]-3-[(1-methylpiperidin-3-yl)methyl]urea
CID 111630982
2-(3,5-dichlorophenoxy)-N-[(1S,4R)-4-(hydroxymethyl)cyclopent-2-en-1-yl]propanamide
CID 111661613
1-(5-hydroxy-4,4-dimethylpentyl)-3-[(1S,4R)-4-(hydroxymethyl)cyclopent-2-en-1-yl]urea
CID 111631321
N-[(1S,4R)-4-(hydroxymethyl)cyclopent-2-en-1-yl]-2-(4-methylphenyl)sulfanylacetamide
CID 111661460

Frequently Asked Questions

What is the IUPAC name of N-[4-(hydroxymethyl)cyclopent-2-en-1-yl]acetamide;vanadium?
The IUPAC name of N-[4-(hydroxymethyl)cyclopent-2-en-1-yl]acetamide;vanadium (CID 162196806) is N-[4-(hydroxymethyl)cyclopent-2-en-1-yl]acetamide;vanadium.
What is the SMILES notation for N-[4-(hydroxymethyl)cyclopent-2-en-1-yl]acetamide;vanadium?
The canonical SMILES for N-[4-(hydroxymethyl)cyclopent-2-en-1-yl]acetamide;vanadium is CC(=O)NC1C=CC(CO)C1.[V].
What is the InChIKey of N-[4-(hydroxymethyl)cyclopent-2-en-1-yl]acetamide;vanadium?
The InChIKey is ZRAXPMNJIPTTAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13NO2.V/c1-6(11)9-8-3-2-7(4-8)5-10;/h2-3,7-8,10H,4-5H2,1H3,(H,9,11);.
What are the key properties of N-[4-(hydroxymethyl)cyclopent-2-en-1-yl]acetamide;vanadium?
N-[4-(hydroxymethyl)cyclopent-2-en-1-yl]acetamide;vanadium has a molecular weight of 206.14 g/mol, XLogP of 0.06, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(hydroxymethyl)cyclopent-2-en-1-yl]acetamide;vanadium is sourced from PubChem (CID 162196806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).