2-hydrazinyl-N-[1-(oxolan-2-yl)ethyl]pyridine-4-carboxamide

C12H18N4O2 — CID 62242671

IUPAC2-hydrazinyl-N-[1-(oxolan-2-yl)ethyl]pyridine-4-carboxamide
SMILESCC(NC(=O)c1ccnc(NN)c1)C1CCCO1
InChIInChI=1S/C12H18N4O2/c1-8(10-3-2-6-18-10)15-12(17)9-4-5-14-11(7-9)16-13/h4-5,7-8,10H,2-3,6,13H2,1H3,(H,14,16)(H,15,17)
InChIKeyXKFAPCLREZVFJR-UHFFFAOYSA-N
MW250.30 g/mol
LogP0.66
Rot. Bonds4

About 2-hydrazinyl-N-[1-(oxolan-2-yl)ethyl]pyridine-4-carboxamide

2-hydrazinyl-N-[1-(oxolan-2-yl)ethyl]pyridine-4-carboxamide (PubChem CID 62242671) has the molecular formula C12H18N4O2 and a molecular weight of 250.30 g/mol. Its IUPAC name is 2-hydrazinyl-N-[1-(oxolan-2-yl)ethyl]pyridine-4-carboxamide.

Molecular Properties

Compound Name2-hydrazinyl-N-[1-(oxolan-2-yl)ethyl]pyridine-4-carboxamide
PubChem CID62242671
Molecular FormulaC12H18N4O2
Molecular Weight250.30 g/mol
Exact Mass250.14
IUPAC Name2-hydrazinyl-N-[1-(oxolan-2-yl)ethyl]pyridine-4-carboxamide
SMILESCC(NC(=O)c1ccnc(NN)c1)C1CCCO1
InChIInChI=1S/C12H18N4O2/c1-8(10-3-2-6-18-10)15-12(17)9-4-5-14-11(7-9)16-13/h4-5,7-8,10H,2-3,6,13H2,1H3,(H,14,16)(H,15,17)
InChIKeyXKFAPCLREZVFJR-UHFFFAOYSA-N
XLogP0.66
TPSA89.27 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 50.66
H-Bond Donors ≤ 53
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

5-hydrazinyl-N-[1-(oxolan-2-yl)ethyl]pyridine-2-carboxamide
CID 104642643
5-N-[(1S)-1-[(2R)-oxolan-2-yl]ethyl]-2-N-[(1R)-1-[(2S)-oxolan-2-yl]ethyl]thiophene-2,5-dicarboxamide
CID 98786018
3-hydrazinyl-4-nitro-N-[1-(oxolan-2-yl)ethyl]benzamide
CID 62680373
3,5-dimethyl-N-[(1R)-1-[(2S)-oxolan-2-yl]ethyl]benzamide
CID 27233431
4-methyl-N-[(1S)-1-[(2R)-oxolan-2-yl]ethyl]benzamide
CID 27232652
N-(1-amino-1-oxopropan-2-yl)-2-hydrazinylpyridine-4-carboxamide
CID 62242876
N-[(1S)-1-[(2R)-oxolan-2-yl]ethyl]-2H-benzotriazole-5-carboxamide
CID 35246882
6-fluoro-N-[1-(oxolan-2-yl)ethyl]pyridine-3-carboxamide
CID 63971995
3-hydroxy-4-iodo-N-[1-(oxolan-2-yl)ethyl]benzamide
CID 104627700
N-[1-(oxolan-2-yl)ethyl]-4-propan-2-ylbenzamide
CID 6468560
1-[(1S)-1-[(2S)-oxolan-2-yl]ethyl]-3-pyridin-2-ylurea
CID 94120386
3-chloro-4-iodo-N-[1-(oxolan-2-yl)ethyl]benzamide
CID 103735000

Frequently Asked Questions

What is the IUPAC name of 2-hydrazinyl-N-[1-(oxolan-2-yl)ethyl]pyridine-4-carboxamide?
The IUPAC name of 2-hydrazinyl-N-[1-(oxolan-2-yl)ethyl]pyridine-4-carboxamide (CID 62242671) is 2-hydrazinyl-N-[1-(oxolan-2-yl)ethyl]pyridine-4-carboxamide.
What is the SMILES notation for 2-hydrazinyl-N-[1-(oxolan-2-yl)ethyl]pyridine-4-carboxamide?
The canonical SMILES for 2-hydrazinyl-N-[1-(oxolan-2-yl)ethyl]pyridine-4-carboxamide is CC(NC(=O)c1ccnc(NN)c1)C1CCCO1.
What is the InChIKey of 2-hydrazinyl-N-[1-(oxolan-2-yl)ethyl]pyridine-4-carboxamide?
The InChIKey is XKFAPCLREZVFJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O2/c1-8(10-3-2-6-18-10)15-12(17)9-4-5-14-11(7-9)16-13/h4-5,7-8,10H,2-3,6,13H2,1H3,(H,14,16)(H,15,17).
What are the key properties of 2-hydrazinyl-N-[1-(oxolan-2-yl)ethyl]pyridine-4-carboxamide?
2-hydrazinyl-N-[1-(oxolan-2-yl)ethyl]pyridine-4-carboxamide has a molecular weight of 250.30 g/mol, XLogP of 0.66, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydrazinyl-N-[1-(oxolan-2-yl)ethyl]pyridine-4-carboxamide is sourced from PubChem (CID 62242671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).