N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-3-hydrazinylpyridine-4-carboxamide

C12H15N5O2 — CID 106377464

IUPACN-[(5-ethyl-1,3-oxazol-2-yl)methyl]-3-hydrazinylpyridine-4-carboxamide
SMILESCCc1cnc(CNC(=O)c2ccncc2NN)o1
InChIInChI=1S/C12H15N5O2/c1-2-8-5-15-11(19-8)7-16-12(18)9-3-4-14-6-10(9)17-13/h3-6,17H,2,7,13H2,1H3,(H,16,18)
InChIKeyWQTUBSDEJVOLLE-UHFFFAOYSA-N
MW261.28 g/mol
LogP0.85
Rot. Bonds5

About N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-3-hydrazinylpyridine-4-carboxamide

N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-3-hydrazinylpyridine-4-carboxamide (PubChem CID 106377464) has the molecular formula C12H15N5O2 and a molecular weight of 261.28 g/mol. Its IUPAC name is N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-3-hydrazinylpyridine-4-carboxamide.

Molecular Properties

Compound NameN-[(5-ethyl-1,3-oxazol-2-yl)methyl]-3-hydrazinylpyridine-4-carboxamide
PubChem CID106377464
Molecular FormulaC12H15N5O2
Molecular Weight261.28 g/mol
Exact Mass261.12
IUPAC NameN-[(5-ethyl-1,3-oxazol-2-yl)methyl]-3-hydrazinylpyridine-4-carboxamide
SMILESCCc1cnc(CNC(=O)c2ccncc2NN)o1
InChIInChI=1S/C12H15N5O2/c1-2-8-5-15-11(19-8)7-16-12(18)9-3-4-14-6-10(9)17-13/h3-6,17H,2,7,13H2,1H3,(H,16,18)
InChIKeyWQTUBSDEJVOLLE-UHFFFAOYSA-N
XLogP0.85
TPSA106.07 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.28
LogP ≤ 50.85
H-Bond Donors ≤ 53
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

N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-3-hydroxypyridine-4-carboxamide
CID 106372873
3-(3-aminoprop-1-ynyl)-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]pyridine-4-carboxamide
CID 106376152
N-[(5-ethylthiophen-2-yl)methyl]-3-hydrazinylpyridine-4-carboxamide
CID 106012825
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-4-hydrazinylpyridine-2-carboxamide
CID 106377448
5-amino-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2,4-dimethylbenzamide
CID 106368562
2-hydrazinyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]benzamide
CID 106377528
N-[(4-fluoro-3,5-dimethylphenyl)methyl]-3-hydrazinylpyridine-4-carboxamide
CID 105072340
N-[2-(ethylamino)-2-oxoethyl]-3-hydrazinylpyridine-4-carboxamide
CID 105072034
3-hydrazinyl-N-(1,3-thiazol-4-ylmethyl)pyridine-4-carboxamide
CID 105072187
5-chloro-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-hydroxybenzamide
CID 104890839
N-[(3-ethyl-1-methylpyrazol-4-yl)methyl]-3-hydrazinylpyridine-4-carboxamide
CID 105072426
2-(4-aminophenyl)-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]acetamide
CID 106368469

Frequently Asked Questions

What is the IUPAC name of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-3-hydrazinylpyridine-4-carboxamide?
The IUPAC name of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-3-hydrazinylpyridine-4-carboxamide (CID 106377464) is N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-3-hydrazinylpyridine-4-carboxamide.
What is the SMILES notation for N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-3-hydrazinylpyridine-4-carboxamide?
The canonical SMILES for N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-3-hydrazinylpyridine-4-carboxamide is CCc1cnc(CNC(=O)c2ccncc2NN)o1.
What is the InChIKey of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-3-hydrazinylpyridine-4-carboxamide?
The InChIKey is WQTUBSDEJVOLLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N5O2/c1-2-8-5-15-11(19-8)7-16-12(18)9-3-4-14-6-10(9)17-13/h3-6,17H,2,7,13H2,1H3,(H,16,18).
What are the key properties of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-3-hydrazinylpyridine-4-carboxamide?
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-3-hydrazinylpyridine-4-carboxamide has a molecular weight of 261.28 g/mol, XLogP of 0.85, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-3-hydrazinylpyridine-4-carboxamide is sourced from PubChem (CID 106377464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).