6-[(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)methyl]pyridine-2-carbohydrazide

C12H15N5O3 — CID 106909437

IUPAC6-[(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)methyl]pyridine-2-carbohydrazide
SMILESCC1(C)NC(=O)N(Cc2cccc(C(=O)NN)n2)C1=O
InChIInChI=1S/C12H15N5O3/c1-12(2)10(19)17(11(20)15-12)6-7-4-3-5-8(14-7)9(18)16-13/h3-5H,6,13H2,1-2H3,(H,15,20)(H,16,18)
InChIKeyIZUVUUBPUBJRBH-UHFFFAOYSA-N
MW277.28 g/mol
LogP-0.48
Rot. Bonds3

About 6-[(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)methyl]pyridine-2-carbohydrazide

6-[(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)methyl]pyridine-2-carbohydrazide (PubChem CID 106909437) has the molecular formula C12H15N5O3 and a molecular weight of 277.28 g/mol. Its IUPAC name is 6-[(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)methyl]pyridine-2-carbohydrazide.

Molecular Properties

Compound Name6-[(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)methyl]pyridine-2-carbohydrazide
PubChem CID106909437
Molecular FormulaC12H15N5O3
Molecular Weight277.28 g/mol
Exact Mass277.12
IUPAC Name6-[(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)methyl]pyridine-2-carbohydrazide
SMILESCC1(C)NC(=O)N(Cc2cccc(C(=O)NN)n2)C1=O
InChIInChI=1S/C12H15N5O3/c1-12(2)10(19)17(11(20)15-12)6-7-4-3-5-8(14-7)9(18)16-13/h3-5H,6,13H2,1-2H3,(H,15,20)(H,16,18)
InChIKeyIZUVUUBPUBJRBH-UHFFFAOYSA-N
XLogP-0.48
TPSA117.42 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.28
LogP ≤ 5-0.48
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

3-[(6-chloro-2-pyridinyl)methyl]-5,5-dimethylimidazolidine-2,4-dione
CID 79240493
6-[(3-methoxy-3-methylpiperidin-1-yl)methyl]pyridine-2-carbohydrazide
CID 107395824
6-[(5-bromo-3-methyl-2-oxo-1-pyridinyl)methyl]pyridine-2-carbohydrazide
CID 106909570
6-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]pyridine-2-carbohydrazide
CID 106908998
5-[(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)methyl]-3-methylfuran-2-carbohydrazide
CID 63572055
6-[(3-methylpiperidin-1-yl)methyl]pyridine-2-carbohydrazide
CID 106909015
6-[(4-butan-2-ylpiperazin-1-yl)methyl]pyridine-2-carbohydrazide
CID 106909093
6-[(3-hydroxypyrrolidin-1-yl)methyl]pyridine-2-carbohydrazide
CID 106909097
6-[(3-aminopyrrolidin-1-yl)methyl]pyridine-2-carbohydrazide
CID 106909083
6-[(3,3-dimethyl-2-oxoindol-1-yl)methyl]pyridine-2-carboxylic acid
CID 178053194
3-[(6-amino-2-pyridinyl)methyl]-1,3-diazaspiro[4.5]decane-2,4-dione
CID 79232630
6-[(6-aminopurin-9-yl)methyl]pyridine-2-carbohydrazide
CID 106909508

Frequently Asked Questions

What is the IUPAC name of 6-[(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)methyl]pyridine-2-carbohydrazide?
The IUPAC name of 6-[(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)methyl]pyridine-2-carbohydrazide (CID 106909437) is 6-[(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)methyl]pyridine-2-carbohydrazide.
What is the SMILES notation for 6-[(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)methyl]pyridine-2-carbohydrazide?
The canonical SMILES for 6-[(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)methyl]pyridine-2-carbohydrazide is CC1(C)NC(=O)N(Cc2cccc(C(=O)NN)n2)C1=O.
What is the InChIKey of 6-[(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)methyl]pyridine-2-carbohydrazide?
The InChIKey is IZUVUUBPUBJRBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N5O3/c1-12(2)10(19)17(11(20)15-12)6-7-4-3-5-8(14-7)9(18)16-13/h3-5H,6,13H2,1-2H3,(H,15,20)(H,16,18).
What are the key properties of 6-[(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)methyl]pyridine-2-carbohydrazide?
6-[(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)methyl]pyridine-2-carbohydrazide has a molecular weight of 277.28 g/mol, XLogP of -0.48, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)methyl]pyridine-2-carbohydrazide is sourced from PubChem (CID 106909437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).