6-[(6-methylcyclohex-3-en-1-yl)methoxymethyl]pyridine-2-carbohydrazide

C15H21N3O2 — CID 106908803

IUPAC6-[(6-methylcyclohex-3-en-1-yl)methoxymethyl]pyridine-2-carbohydrazide
SMILESCC1CC=CCC1COCc1cccc(C(=O)NN)n1
InChIInChI=1S/C15H21N3O2/c1-11-5-2-3-6-12(11)9-20-10-13-7-4-8-14(17-13)15(19)18-16/h2-4,7-8,11-12H,5-6,9-10,16H2,1H3,(H,18,19)
InChIKeyXLYVWMJWTPYHBE-UHFFFAOYSA-N
MW275.35 g/mol
LogP1.80
Rot. Bonds5

About 6-[(6-methylcyclohex-3-en-1-yl)methoxymethyl]pyridine-2-carbohydrazide

6-[(6-methylcyclohex-3-en-1-yl)methoxymethyl]pyridine-2-carbohydrazide (PubChem CID 106908803) has the molecular formula C15H21N3O2 and a molecular weight of 275.35 g/mol. Its IUPAC name is 6-[(6-methylcyclohex-3-en-1-yl)methoxymethyl]pyridine-2-carbohydrazide.

Molecular Properties

Compound Name6-[(6-methylcyclohex-3-en-1-yl)methoxymethyl]pyridine-2-carbohydrazide
PubChem CID106908803
Molecular FormulaC15H21N3O2
Molecular Weight275.35 g/mol
Exact Mass275.16
IUPAC Name6-[(6-methylcyclohex-3-en-1-yl)methoxymethyl]pyridine-2-carbohydrazide
SMILESCC1CC=CCC1COCc1cccc(C(=O)NN)n1
InChIInChI=1S/C15H21N3O2/c1-11-5-2-3-6-12(11)9-20-10-13-7-4-8-14(17-13)15(19)18-16/h2-4,7-8,11-12H,5-6,9-10,16H2,1H3,(H,18,19)
InChIKeyXLYVWMJWTPYHBE-UHFFFAOYSA-N
XLogP1.80
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 51.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

5-[(6-methylcyclohex-3-en-1-yl)methoxymethyl]-1,2-oxazole-3-carbohydrazide
CID 63574753
6-(2-methylpentoxymethyl)pyridine-2-carbohydrazide
CID 106908991
6-[(2-ethylcyclohexyl)oxymethyl]pyridine-2-carbohydrazide
CID 106908788
6-(4,4,4-trifluorobutoxymethyl)pyridine-2-carbohydrazide
CID 106908961
6-(2-pyridin-2-ylethoxymethyl)pyridine-2-carbohydrazide
CID 106908801
6-[(3-propan-2-ylphenoxy)methyl]pyridine-2-carbohydrazide
CID 106908816
6-[[bis(cyclopropylmethyl)amino]methyl]pyridine-2-carbohydrazide
CID 106909293
6-[[butyl(methyl)amino]methyl]pyridine-2-carbohydrazide
CID 106909022
6-[[cyclopropyl(2-methoxyethyl)amino]methyl]pyridine-2-carbohydrazide
CID 106909183
3-[[6-(hydrazinecarbonyl)-2-pyridinyl]methyl-methylamino]-N-methylpropanamide
CID 106918242
6-(pyridin-3-yloxymethyl)pyridine-2-carbohydrazide
CID 106908908
6-[(N,3,5-trimethylanilino)methyl]pyridine-2-carbohydrazide
CID 106909203

Frequently Asked Questions

What is the IUPAC name of 6-[(6-methylcyclohex-3-en-1-yl)methoxymethyl]pyridine-2-carbohydrazide?
The IUPAC name of 6-[(6-methylcyclohex-3-en-1-yl)methoxymethyl]pyridine-2-carbohydrazide (CID 106908803) is 6-[(6-methylcyclohex-3-en-1-yl)methoxymethyl]pyridine-2-carbohydrazide.
What is the SMILES notation for 6-[(6-methylcyclohex-3-en-1-yl)methoxymethyl]pyridine-2-carbohydrazide?
The canonical SMILES for 6-[(6-methylcyclohex-3-en-1-yl)methoxymethyl]pyridine-2-carbohydrazide is CC1CC=CCC1COCc1cccc(C(=O)NN)n1.
What is the InChIKey of 6-[(6-methylcyclohex-3-en-1-yl)methoxymethyl]pyridine-2-carbohydrazide?
The InChIKey is XLYVWMJWTPYHBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O2/c1-11-5-2-3-6-12(11)9-20-10-13-7-4-8-14(17-13)15(19)18-16/h2-4,7-8,11-12H,5-6,9-10,16H2,1H3,(H,18,19).
What are the key properties of 6-[(6-methylcyclohex-3-en-1-yl)methoxymethyl]pyridine-2-carbohydrazide?
6-[(6-methylcyclohex-3-en-1-yl)methoxymethyl]pyridine-2-carbohydrazide has a molecular weight of 275.35 g/mol, XLogP of 1.80, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(6-methylcyclohex-3-en-1-yl)methoxymethyl]pyridine-2-carbohydrazide is sourced from PubChem (CID 106908803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).