1-[(2-hydrazinyl-4-pyridinyl)methyl]-4-propylpiperazine-2,5-dione

C13H19N5O2 — CID 79941401

IUPAC1-[(2-hydrazinyl-4-pyridinyl)methyl]-4-propylpiperazine-2,5-dione
SMILESCCCN1CC(=O)N(Cc2ccnc(NN)c2)CC1=O
InChIInChI=1S/C13H19N5O2/c1-2-5-17-8-13(20)18(9-12(17)19)7-10-3-4-15-11(6-10)16-14/h3-4,6H,2,5,7-9,14H2,1H3,(H,15,16)
InChIKeyDDWCBZPUBNPNOZ-UHFFFAOYSA-N
MW277.33 g/mol
LogP-0.05
Rot. Bonds5

About 1-[(2-hydrazinyl-4-pyridinyl)methyl]-4-propylpiperazine-2,5-dione

1-[(2-hydrazinyl-4-pyridinyl)methyl]-4-propylpiperazine-2,5-dione (PubChem CID 79941401) has the molecular formula C13H19N5O2 and a molecular weight of 277.33 g/mol. Its IUPAC name is 1-[(2-hydrazinyl-4-pyridinyl)methyl]-4-propylpiperazine-2,5-dione.

Molecular Properties

Compound Name1-[(2-hydrazinyl-4-pyridinyl)methyl]-4-propylpiperazine-2,5-dione
PubChem CID79941401
Molecular FormulaC13H19N5O2
Molecular Weight277.33 g/mol
Exact Mass277.15
IUPAC Name1-[(2-hydrazinyl-4-pyridinyl)methyl]-4-propylpiperazine-2,5-dione
SMILESCCCN1CC(=O)N(Cc2ccnc(NN)c2)CC1=O
InChIInChI=1S/C13H19N5O2/c1-2-5-17-8-13(20)18(9-12(17)19)7-10-3-4-15-11(6-10)16-14/h3-4,6H,2,5,7-9,14H2,1H3,(H,15,16)
InChIKeyDDWCBZPUBNPNOZ-UHFFFAOYSA-N
XLogP-0.05
TPSA91.56 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.33
LogP ≤ 5-0.05
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

N,N'-bis(5-methylpyridin-2-yl)ethanediamide
CID 2166281
2-(methylamino)-N-(4-methylpyridin-2-yl)acetamide
CID 28399469
1-[2-Oxo-2-(2-pyridinylamino)ethyl]-4-piperidinecarboxamide
CID 2917692
N-isopropyl-N''-[[3-keto-1-methyl-3-[(4-methyl-2-pyridyl)amino]propylidene]amino]oxamide
CID 9592197
2-Oxo-2-piperidin-1-yl-N-pyridin-2-yl-acetamide
CID 2205831
4-acetyl-N-(4-methyl-2-pyridinyl)piperazine-1-carbothioamide
CID 49852805
2-Hydrazinyl-4-methylpyridine
CID 12266739
4-Amino-1-[2-oxo-2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]pyrimidin-2-one
CID 44144262
N~2~-methyl-N~1~-{1-[5-(trifluoromethyl)-2-pyridinyl]-3-piperidinyl}glycinamide
CID 56883883
N'-pyridin-2-ylpyridine-4-carbohydrazide
CID 12499591
1-acetyl-N-(4-methylpyridin-2-yl)piperidine-4-carboxamide
CID 6468197
Acetamide, 2-(diethylamino)-N-(4-methyl-2-pyridyl)-, dihydrochloride
CID 3060143

Frequently Asked Questions

What is the IUPAC name of 1-[(2-hydrazinyl-4-pyridinyl)methyl]-4-propylpiperazine-2,5-dione?
The IUPAC name of 1-[(2-hydrazinyl-4-pyridinyl)methyl]-4-propylpiperazine-2,5-dione (CID 79941401) is 1-[(2-hydrazinyl-4-pyridinyl)methyl]-4-propylpiperazine-2,5-dione.
What is the SMILES notation for 1-[(2-hydrazinyl-4-pyridinyl)methyl]-4-propylpiperazine-2,5-dione?
The canonical SMILES for 1-[(2-hydrazinyl-4-pyridinyl)methyl]-4-propylpiperazine-2,5-dione is CCCN1CC(=O)N(Cc2ccnc(NN)c2)CC1=O.
What is the InChIKey of 1-[(2-hydrazinyl-4-pyridinyl)methyl]-4-propylpiperazine-2,5-dione?
The InChIKey is DDWCBZPUBNPNOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N5O2/c1-2-5-17-8-13(20)18(9-12(17)19)7-10-3-4-15-11(6-10)16-14/h3-4,6H,2,5,7-9,14H2,1H3,(H,15,16).
What are the key properties of 1-[(2-hydrazinyl-4-pyridinyl)methyl]-4-propylpiperazine-2,5-dione?
1-[(2-hydrazinyl-4-pyridinyl)methyl]-4-propylpiperazine-2,5-dione has a molecular weight of 277.33 g/mol, XLogP of -0.05, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-hydrazinyl-4-pyridinyl)methyl]-4-propylpiperazine-2,5-dione is sourced from PubChem (CID 79941401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).