(3,4-dihydroxypyrrolidin-1-yl)-(3-hydrazinyl-4-pyridinyl)methanone

C10H14N4O3 — CID 106673919

IUPAC(3,4-dihydroxypyrrolidin-1-yl)-(3-hydrazinyl-4-pyridinyl)methanone
SMILESNNc1cnccc1C(=O)N1CC(O)C(O)C1
InChIInChI=1S/C10H14N4O3/c11-13-7-3-12-2-1-6(7)10(17)14-4-8(15)9(16)5-14/h1-3,8-9,13,15-16H,4-5,11H2
InChIKeyNMIYNVZPVVMXLD-UHFFFAOYSA-N
MW238.25 g/mol
LogP-1.46
Rot. Bonds2

About (3,4-dihydroxypyrrolidin-1-yl)-(3-hydrazinyl-4-pyridinyl)methanone

(3,4-dihydroxypyrrolidin-1-yl)-(3-hydrazinyl-4-pyridinyl)methanone (PubChem CID 106673919) has the molecular formula C10H14N4O3 and a molecular weight of 238.25 g/mol. Its IUPAC name is (3,4-dihydroxypyrrolidin-1-yl)-(3-hydrazinyl-4-pyridinyl)methanone.

Molecular Properties

Compound Name(3,4-dihydroxypyrrolidin-1-yl)-(3-hydrazinyl-4-pyridinyl)methanone
PubChem CID106673919
Molecular FormulaC10H14N4O3
Molecular Weight238.25 g/mol
Exact Mass238.11
IUPAC Name(3,4-dihydroxypyrrolidin-1-yl)-(3-hydrazinyl-4-pyridinyl)methanone
SMILESNNc1cnccc1C(=O)N1CC(O)C(O)C1
InChIInChI=1S/C10H14N4O3/c11-13-7-3-12-2-1-6(7)10(17)14-4-8(15)9(16)5-14/h1-3,8-9,13,15-16H,4-5,11H2
InChIKeyNMIYNVZPVVMXLD-UHFFFAOYSA-N
XLogP-1.46
TPSA111.71 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.25
LogP ≤ 5-1.46
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

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

(3-hydrazinyl-4-pyridinyl)-(4-hydroxy-3-methylpiperidin-1-yl)methanone
CID 105072540
4-(3-hydrazinylpyridine-4-carbonyl)piperazine-2,6-dione
CID 105072287
(3-hydrazinyl-4-pyridinyl)-(2-methyl-1,4-oxazepan-4-yl)methanone
CID 105072116
(3-hydrazinyl-4-pyridinyl)-(4-propan-2-ylpiperazin-1-yl)methanone
CID 105072063
(3-hydrazinyl-4-pyridinyl)-[3-(trifluoromethyl)piperidin-1-yl]methanone
CID 105072274
(3,3-diethylpyrrolidin-1-yl)-(3-hydrazinyl-4-pyridinyl)methanone
CID 105072328
(3-hydrazinyl-4-pyridinyl)-[4-(1,3-thiazol-2-yl)piperazin-1-yl]methanone
CID 105071524
[3-(methylamino)-4-pyridinyl]-(3,4,5-trimethylpiperazin-1-yl)methanone
CID 105071443
(3,4-dihydroxypyrrolidin-1-yl)-(4-hydrazinyl-6-methyl-3-pyridinyl)methanone
CID 106673912
(E)-3-[4-(3,4-dihydroxypyrrolidine-1-carbonyl)-3-pyridinyl]prop-2-enoic acid
CID 106673598
(2,3-dimethylthiomorpholin-4-yl)-(3-hydrazinyl-4-pyridinyl)methanone
CID 105072517
[(2R,6S)-2,6-dimethylmorpholin-4-yl]-[3-(ethylamino)-4-pyridinyl]methanone
CID 105071465

Frequently Asked Questions

What is the IUPAC name of (3,4-dihydroxypyrrolidin-1-yl)-(3-hydrazinyl-4-pyridinyl)methanone?
The IUPAC name of (3,4-dihydroxypyrrolidin-1-yl)-(3-hydrazinyl-4-pyridinyl)methanone (CID 106673919) is (3,4-dihydroxypyrrolidin-1-yl)-(3-hydrazinyl-4-pyridinyl)methanone.
What is the SMILES notation for (3,4-dihydroxypyrrolidin-1-yl)-(3-hydrazinyl-4-pyridinyl)methanone?
The canonical SMILES for (3,4-dihydroxypyrrolidin-1-yl)-(3-hydrazinyl-4-pyridinyl)methanone is NNc1cnccc1C(=O)N1CC(O)C(O)C1.
What is the InChIKey of (3,4-dihydroxypyrrolidin-1-yl)-(3-hydrazinyl-4-pyridinyl)methanone?
The InChIKey is NMIYNVZPVVMXLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4O3/c11-13-7-3-12-2-1-6(7)10(17)14-4-8(15)9(16)5-14/h1-3,8-9,13,15-16H,4-5,11H2.
What are the key properties of (3,4-dihydroxypyrrolidin-1-yl)-(3-hydrazinyl-4-pyridinyl)methanone?
(3,4-dihydroxypyrrolidin-1-yl)-(3-hydrazinyl-4-pyridinyl)methanone has a molecular weight of 238.25 g/mol, XLogP of -1.46, 2 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (3,4-dihydroxypyrrolidin-1-yl)-(3-hydrazinyl-4-pyridinyl)methanone is sourced from PubChem (CID 106673919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).