N'-[2-(2-oxo-2-pyrrolidin-1-ylethoxy)acetyl]pyridine-3-carbohydrazide

C14H18N4O4 — CID 3971401

IUPACN'-[2-(2-oxo-2-pyrrolidin-1-ylethoxy)acetyl]pyridine-3-carbohydrazide
SMILESO=C(COCC(=O)N1CCCC1)NNC(=O)c1cccnc1
InChIInChI=1S/C14H18N4O4/c19-12(9-22-10-13(20)18-6-1-2-7-18)16-17-14(21)11-4-3-5-15-8-11/h3-5,8H,1-2,6-7,9-10H2,(H,16,19)(H,17,21)
InChIKeyCSRWXQCWWWOUQE-UHFFFAOYSA-N
MW306.32 g/mol
LogP-0.52
Rot. Bonds5

About N'-[2-(2-oxo-2-pyrrolidin-1-ylethoxy)acetyl]pyridine-3-carbohydrazide

N'-[2-(2-oxo-2-pyrrolidin-1-ylethoxy)acetyl]pyridine-3-carbohydrazide (PubChem CID 3971401) has the molecular formula C14H18N4O4 and a molecular weight of 306.32 g/mol. Its IUPAC name is N'-[2-(2-oxo-2-pyrrolidin-1-ylethoxy)acetyl]pyridine-3-carbohydrazide.

Molecular Properties

Compound NameN'-[2-(2-oxo-2-pyrrolidin-1-ylethoxy)acetyl]pyridine-3-carbohydrazide
PubChem CID3971401
Molecular FormulaC14H18N4O4
Molecular Weight306.32 g/mol
Exact Mass306.13
IUPAC NameN'-[2-(2-oxo-2-pyrrolidin-1-ylethoxy)acetyl]pyridine-3-carbohydrazide
SMILESO=C(COCC(=O)N1CCCC1)NNC(=O)c1cccnc1
InChIInChI=1S/C14H18N4O4/c19-12(9-22-10-13(20)18-6-1-2-7-18)16-17-14(21)11-4-3-5-15-8-11/h3-5,8H,1-2,6-7,9-10H2,(H,16,19)(H,17,21)
InChIKeyCSRWXQCWWWOUQE-UHFFFAOYSA-N
XLogP-0.52
TPSA100.63 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.32
LogP ≤ 5-0.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

1-pyridin-3-yl-3-pyrrolidin-1-ylpropane-1,3-dione
CID 22925185
N'-[2-(4-methylphenoxy)acetyl]pyridine-3-carbohydrazide
CID 839627
1-piperidin-1-yl-2-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methoxy]ethanone
CID 75538435
N'-[2-(3,4-dihydro-2H-quinolin-1-yl)acetyl]pyridine-3-carbohydrazide
CID 51109543
N'-(4-oxo-4-phenylbutanoyl)pyridine-3-carbohydrazide
CID 35152458
N'-[4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-4-oxobutanoyl]pyridine-3-carbohydrazide
CID 55872031
N'-[2-(3-methoxyphenoxy)acetyl]pyridine-3-carbohydrazide
CID 17386186
N-[(2S)-4-methyl-1-oxo-1-piperidin-1-ylpentan-2-yl]pyridine-3-carboxamide
CID 110351611
1-[4-(pyridine-3-carbonyl)-1,4-diazepan-1-yl]butan-1-one
CID 84550235
N'-(3-pyrrolidin-1-ylsulfonylbenzoyl)pyridine-3-carbohydrazide
CID 46523062
N-[2-[[N-ethyl-N'-(2-oxo-2-pyrrolidin-1-ylethyl)carbamimidoyl]amino]ethyl]pyridine-3-carboxamide;hydroiodide
CID 111929650
2-phenylmethoxy-1-[4-(pyridin-3-ylmethyl)-1,4-diazepan-1-yl]ethanone
CID 70721631

Frequently Asked Questions

What is the IUPAC name of N'-[2-(2-oxo-2-pyrrolidin-1-ylethoxy)acetyl]pyridine-3-carbohydrazide?
The IUPAC name of N'-[2-(2-oxo-2-pyrrolidin-1-ylethoxy)acetyl]pyridine-3-carbohydrazide (CID 3971401) is N'-[2-(2-oxo-2-pyrrolidin-1-ylethoxy)acetyl]pyridine-3-carbohydrazide.
What is the SMILES notation for N'-[2-(2-oxo-2-pyrrolidin-1-ylethoxy)acetyl]pyridine-3-carbohydrazide?
The canonical SMILES for N'-[2-(2-oxo-2-pyrrolidin-1-ylethoxy)acetyl]pyridine-3-carbohydrazide is O=C(COCC(=O)N1CCCC1)NNC(=O)c1cccnc1.
What is the InChIKey of N'-[2-(2-oxo-2-pyrrolidin-1-ylethoxy)acetyl]pyridine-3-carbohydrazide?
The InChIKey is CSRWXQCWWWOUQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O4/c19-12(9-22-10-13(20)18-6-1-2-7-18)16-17-14(21)11-4-3-5-15-8-11/h3-5,8H,1-2,6-7,9-10H2,(H,16,19)(H,17,21).
What are the key properties of N'-[2-(2-oxo-2-pyrrolidin-1-ylethoxy)acetyl]pyridine-3-carbohydrazide?
N'-[2-(2-oxo-2-pyrrolidin-1-ylethoxy)acetyl]pyridine-3-carbohydrazide has a molecular weight of 306.32 g/mol, XLogP of -0.52, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(2-oxo-2-pyrrolidin-1-ylethoxy)acetyl]pyridine-3-carbohydrazide is sourced from PubChem (CID 3971401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).