(2-arsanylcarbonylpyrrolidin-1-yl)-pyrrolidin-2-ylmethanone

C10H17AsN2O2 — CID 173334366

IUPAC(2-arsanylcarbonylpyrrolidin-1-yl)-pyrrolidin-2-ylmethanone
SMILESO=C([AsH2])C1CCCN1C(=O)C1CCCN1
InChIInChI=1S/C10H17AsN2O2/c11-9(14)8-4-2-6-13(8)10(15)7-3-1-5-12-7/h7-8,12H,1-6,11H2
InChIKeySYBZDXURNITJGH-UHFFFAOYSA-N
MW272.18 g/mol
LogP-1.11
Rot. Bonds2

About (2-arsanylcarbonylpyrrolidin-1-yl)-pyrrolidin-2-ylmethanone

(2-arsanylcarbonylpyrrolidin-1-yl)-pyrrolidin-2-ylmethanone (PubChem CID 173334366) has the molecular formula C10H17AsN2O2 and a molecular weight of 272.18 g/mol. Its IUPAC name is (2-arsanylcarbonylpyrrolidin-1-yl)-pyrrolidin-2-ylmethanone.

Molecular Properties

Compound Name(2-arsanylcarbonylpyrrolidin-1-yl)-pyrrolidin-2-ylmethanone
PubChem CID173334366
Molecular FormulaC10H17AsN2O2
Molecular Weight272.18 g/mol
Exact Mass272.05
IUPAC Name(2-arsanylcarbonylpyrrolidin-1-yl)-pyrrolidin-2-ylmethanone
SMILESO=C([AsH2])C1CCCN1C(=O)C1CCCN1
InChIInChI=1S/C10H17AsN2O2/c11-9(14)8-4-2-6-13(8)10(15)7-3-1-5-12-7/h7-8,12H,1-6,11H2
InChIKeySYBZDXURNITJGH-UHFFFAOYSA-N
XLogP-1.11
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.18
LogP ≤ 5-1.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

[(2S)-2-arsanylcarbonylpyrrolidin-1-yl]-[(2S)-pyrrolidin-2-yl]methanone
CID 173334367
1-[(2S)-pyrrolidine-2-carbonyl]pyrrolidine-2-carboxylic acid
CID 61158797
(2R)-1-[(2R)-pyrrolidine-2-carbonyl]pyrrolidine-2-carboxylate
CID 132526338
(2S)-1-[(2S)-1-[(2S)-1-[(2S)-1-[(2S)-1-[(2S)-1-[(2S)-1-[(2S)-1-[(2S)-1-[(2S)-1-[(2S)-1-[(2S)-1-[(2S)-1-[(2S)-1-[(2S)-1-[(2S)-1-[(2S)-1-[(2S)-pyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carboxylic acid
CID 102311837
acetic acid;(2S)-1-[(2S)-pyrrolidine-2-carbonyl]pyrrolidine-2-carboxylic acid
CID 175939790
(2R)-1-(piperidine-2-carbonyl)pyrrolidine-2-carboxylic acid
CID 78923169
1-(pyrrolidine-2-carbonyl)piperidine-2-carboxylic acid
CID 61157904
1-[(2S)-pyrrolidine-2-carbonyl]piperidine-2-carboxylic acid
CID 61158281
N,N-dimethyl-1-(pyrrolidine-2-carbonyl)pyrrolidine-2-carboxamide
CID 43579479
(2S)-N-methyl-1-[(2S)-pyrrolidine-2-carbonyl]pyrrolidine-2-carboxamide
CID 93376645
1-[(2S)-piperidine-2-carbonyl]pyrrolidine-2-carboxamide
CID 104912709
(2S)-N-cyclopropyl-1-[(2S)-pyrrolidine-2-carbonyl]pyrrolidine-2-carboxamide
CID 93369523

Frequently Asked Questions

What is the IUPAC name of (2-arsanylcarbonylpyrrolidin-1-yl)-pyrrolidin-2-ylmethanone?
The IUPAC name of (2-arsanylcarbonylpyrrolidin-1-yl)-pyrrolidin-2-ylmethanone (CID 173334366) is (2-arsanylcarbonylpyrrolidin-1-yl)-pyrrolidin-2-ylmethanone.
What is the SMILES notation for (2-arsanylcarbonylpyrrolidin-1-yl)-pyrrolidin-2-ylmethanone?
The canonical SMILES for (2-arsanylcarbonylpyrrolidin-1-yl)-pyrrolidin-2-ylmethanone is O=C([AsH2])C1CCCN1C(=O)C1CCCN1.
What is the InChIKey of (2-arsanylcarbonylpyrrolidin-1-yl)-pyrrolidin-2-ylmethanone?
The InChIKey is SYBZDXURNITJGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17AsN2O2/c11-9(14)8-4-2-6-13(8)10(15)7-3-1-5-12-7/h7-8,12H,1-6,11H2.
What are the key properties of (2-arsanylcarbonylpyrrolidin-1-yl)-pyrrolidin-2-ylmethanone?
(2-arsanylcarbonylpyrrolidin-1-yl)-pyrrolidin-2-ylmethanone has a molecular weight of 272.18 g/mol, XLogP of -1.11, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-arsanylcarbonylpyrrolidin-1-yl)-pyrrolidin-2-ylmethanone is sourced from PubChem (CID 173334366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).