(5-hydrazinyl-2-pyridinyl)-(3-methoxypyrrolidin-1-yl)methanone

C11H16N4O2 — CID 103538701

IUPAC(5-hydrazinyl-2-pyridinyl)-(3-methoxypyrrolidin-1-yl)methanone
SMILESCOC1CCN(C(=O)c2ccc(NN)cn2)C1
InChIInChI=1S/C11H16N4O2/c1-17-9-4-5-15(7-9)11(16)10-3-2-8(14-12)6-13-10/h2-3,6,9,14H,4-5,7,12H2,1H3
InChIKeyCABXZUOULORMAL-UHFFFAOYSA-N
MW236.27 g/mol
LogP0.23
Rot. Bonds3

About (5-hydrazinyl-2-pyridinyl)-(3-methoxypyrrolidin-1-yl)methanone

(5-hydrazinyl-2-pyridinyl)-(3-methoxypyrrolidin-1-yl)methanone (PubChem CID 103538701) has the molecular formula C11H16N4O2 and a molecular weight of 236.27 g/mol. Its IUPAC name is (5-hydrazinyl-2-pyridinyl)-(3-methoxypyrrolidin-1-yl)methanone.

Molecular Properties

Compound Name(5-hydrazinyl-2-pyridinyl)-(3-methoxypyrrolidin-1-yl)methanone
PubChem CID103538701
Molecular FormulaC11H16N4O2
Molecular Weight236.27 g/mol
Exact Mass236.13
IUPAC Name(5-hydrazinyl-2-pyridinyl)-(3-methoxypyrrolidin-1-yl)methanone
SMILESCOC1CCN(C(=O)c2ccc(NN)cn2)C1
InChIInChI=1S/C11H16N4O2/c1-17-9-4-5-15(7-9)11(16)10-3-2-8(14-12)6-13-10/h2-3,6,9,14H,4-5,7,12H2,1H3
InChIKeyCABXZUOULORMAL-UHFFFAOYSA-N
XLogP0.23
TPSA80.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.27
LogP ≤ 50.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

6-(3-methoxypyrrolidine-1-carbonyl)pyridine-3-carboxylic acid
CID 103536805
(5-hydrazinyl-2-pyridinyl)-(2-methylmorpholin-4-yl)methanone
CID 104642344
azepan-1-yl-(5-hydrazinyl-2-pyridinyl)methanone
CID 104642343
(5-hydrazinyl-2-pyridinyl)-(3,3,4-trimethylpiperazin-1-yl)methanone
CID 104642780
[(2S,6R)-2,6-dimethylpiperidin-1-yl]-(5-hydrazinyl-2-pyridinyl)methanone
CID 104968896
(3-methoxypyrrolidin-1-yl)-(2H-triazol-4-yl)methanone
CID 103536935
(3,3-dimethylpiperidin-1-yl)-(5-hydrazinyl-2-pyridinyl)methanone
CID 104642815
(5-hydrazinyl-2-pyridinyl)-(2-methylpiperidin-1-yl)methanone
CID 104642325
[6-(ethylamino)pyridazin-3-yl]-(3-methoxypyrrolidin-1-yl)methanone
CID 103538464
1,3-dihydroisoindol-2-yl-(5-hydrazinyl-2-pyridinyl)methanone
CID 113436314
[4-(dimethylamino)piperidin-1-yl]-[5-(methylamino)-2-pyridinyl]methanone
CID 104640276
(4-ethyl-4-methylpiperidin-1-yl)-(5-hydrazinyl-2-pyridinyl)methanone
CID 113436346

Frequently Asked Questions

What is the IUPAC name of (5-hydrazinyl-2-pyridinyl)-(3-methoxypyrrolidin-1-yl)methanone?
The IUPAC name of (5-hydrazinyl-2-pyridinyl)-(3-methoxypyrrolidin-1-yl)methanone (CID 103538701) is (5-hydrazinyl-2-pyridinyl)-(3-methoxypyrrolidin-1-yl)methanone.
What is the SMILES notation for (5-hydrazinyl-2-pyridinyl)-(3-methoxypyrrolidin-1-yl)methanone?
The canonical SMILES for (5-hydrazinyl-2-pyridinyl)-(3-methoxypyrrolidin-1-yl)methanone is COC1CCN(C(=O)c2ccc(NN)cn2)C1.
What is the InChIKey of (5-hydrazinyl-2-pyridinyl)-(3-methoxypyrrolidin-1-yl)methanone?
The InChIKey is CABXZUOULORMAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O2/c1-17-9-4-5-15(7-9)11(16)10-3-2-8(14-12)6-13-10/h2-3,6,9,14H,4-5,7,12H2,1H3.
What are the key properties of (5-hydrazinyl-2-pyridinyl)-(3-methoxypyrrolidin-1-yl)methanone?
(5-hydrazinyl-2-pyridinyl)-(3-methoxypyrrolidin-1-yl)methanone has a molecular weight of 236.27 g/mol, XLogP of 0.23, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (5-hydrazinyl-2-pyridinyl)-(3-methoxypyrrolidin-1-yl)methanone is sourced from PubChem (CID 103538701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).