N-[2-(dimethylcarbamoylamino)ethyl]-5-hydrazinylpyridine-2-carboxamide

C11H18N6O2 — CID 113436386

IUPACN-[2-(dimethylcarbamoylamino)ethyl]-5-hydrazinylpyridine-2-carboxamide
SMILESCN(C)C(=O)NCCNC(=O)c1ccc(NN)cn1
InChIInChI=1S/C11H18N6O2/c1-17(2)11(19)14-6-5-13-10(18)9-4-3-8(16-12)7-15-9/h3-4,7,16H,5-6,12H2,1-2H3,(H,13,18)(H,14,19)
InChIKeyVHHZCMACTOZAPP-UHFFFAOYSA-N
MW266.31 g/mol
LogP-0.63
Rot. Bonds5

About N-[2-(dimethylcarbamoylamino)ethyl]-5-hydrazinylpyridine-2-carboxamide

N-[2-(dimethylcarbamoylamino)ethyl]-5-hydrazinylpyridine-2-carboxamide (PubChem CID 113436386) has the molecular formula C11H18N6O2 and a molecular weight of 266.31 g/mol. Its IUPAC name is N-[2-(dimethylcarbamoylamino)ethyl]-5-hydrazinylpyridine-2-carboxamide.

Molecular Properties

Compound NameN-[2-(dimethylcarbamoylamino)ethyl]-5-hydrazinylpyridine-2-carboxamide
PubChem CID113436386
Molecular FormulaC11H18N6O2
Molecular Weight266.31 g/mol
Exact Mass266.15
IUPAC NameN-[2-(dimethylcarbamoylamino)ethyl]-5-hydrazinylpyridine-2-carboxamide
SMILESCN(C)C(=O)NCCNC(=O)c1ccc(NN)cn1
InChIInChI=1S/C11H18N6O2/c1-17(2)11(19)14-6-5-13-10(18)9-4-3-8(16-12)7-15-9/h3-4,7,16H,5-6,12H2,1-2H3,(H,13,18)(H,14,19)
InChIKeyVHHZCMACTOZAPP-UHFFFAOYSA-N
XLogP-0.63
TPSA112.38 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.31
LogP ≤ 5-0.63
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

5-hydrazinyl-N-propylpyridine-2-carboxamide
CID 104642261
5-hydrazinyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]pyridine-2-carboxamide
CID 104642797
3-[2-[(6-amino-3-pyridinyl)amino]ethyl]-1,1-dimethylurea
CID 83116884
5-hydrazinyl-N-[2-(1-methylpyrazol-4-yl)ethyl]pyridine-2-carboxamide
CID 113436378
5-hydrazinyl-N-[2-(2-methylpyrazol-3-yl)ethyl]pyridine-2-carboxamide
CID 103011437
N,N-diethyl-5-hydrazinylpyridine-2-carboxamide
CID 104642323
N-(cyclopropylmethyl)-5-hydrazinylpyridine-2-carboxamide
CID 104642346
5-hydrazinyl-N-[2-(1-methylpiperidin-4-yl)ethyl]pyridine-2-carboxamide
CID 114516677
N-[2-[cyclopropyl(methyl)amino]propyl]-5-hydrazinylpyridine-2-carboxamide
CID 114133319
N-(3-ethylpentan-3-yl)-5-hydrazinylpyridine-2-carboxamide
CID 104642862
5-hydrazinyl-N-(pyridin-4-ylmethyl)pyridine-2-carboxamide
CID 104642246
5-hydrazinyl-N-[2-(triazol-1-yl)ethyl]pyridine-2-carboxamide
CID 104643051

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylcarbamoylamino)ethyl]-5-hydrazinylpyridine-2-carboxamide?
The IUPAC name of N-[2-(dimethylcarbamoylamino)ethyl]-5-hydrazinylpyridine-2-carboxamide (CID 113436386) is N-[2-(dimethylcarbamoylamino)ethyl]-5-hydrazinylpyridine-2-carboxamide.
What is the SMILES notation for N-[2-(dimethylcarbamoylamino)ethyl]-5-hydrazinylpyridine-2-carboxamide?
The canonical SMILES for N-[2-(dimethylcarbamoylamino)ethyl]-5-hydrazinylpyridine-2-carboxamide is CN(C)C(=O)NCCNC(=O)c1ccc(NN)cn1.
What is the InChIKey of N-[2-(dimethylcarbamoylamino)ethyl]-5-hydrazinylpyridine-2-carboxamide?
The InChIKey is VHHZCMACTOZAPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N6O2/c1-17(2)11(19)14-6-5-13-10(18)9-4-3-8(16-12)7-15-9/h3-4,7,16H,5-6,12H2,1-2H3,(H,13,18)(H,14,19).
What are the key properties of N-[2-(dimethylcarbamoylamino)ethyl]-5-hydrazinylpyridine-2-carboxamide?
N-[2-(dimethylcarbamoylamino)ethyl]-5-hydrazinylpyridine-2-carboxamide has a molecular weight of 266.31 g/mol, XLogP of -0.63, 5 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylcarbamoylamino)ethyl]-5-hydrazinylpyridine-2-carboxamide is sourced from PubChem (CID 113436386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).