6-[(3-methoxy-3-methylpiperidin-1-yl)methyl]pyridine-2-carbohydrazide

C14H22N4O2 — CID 107395824

IUPAC6-[(3-methoxy-3-methylpiperidin-1-yl)methyl]pyridine-2-carbohydrazide
SMILESCOC1(C)CCCN(Cc2cccc(C(=O)NN)n2)C1
InChIInChI=1S/C14H22N4O2/c1-14(20-2)7-4-8-18(10-14)9-11-5-3-6-12(16-11)13(19)17-15/h3,5-6H,4,7-10,15H2,1-2H3,(H,17,19)
InChIKeyYJIFAWDYNCRBQT-UHFFFAOYSA-N
MW278.36 g/mol
LogP0.69
Rot. Bonds4

About 6-[(3-methoxy-3-methylpiperidin-1-yl)methyl]pyridine-2-carbohydrazide

6-[(3-methoxy-3-methylpiperidin-1-yl)methyl]pyridine-2-carbohydrazide (PubChem CID 107395824) has the molecular formula C14H22N4O2 and a molecular weight of 278.36 g/mol. Its IUPAC name is 6-[(3-methoxy-3-methylpiperidin-1-yl)methyl]pyridine-2-carbohydrazide.

Molecular Properties

Compound Name6-[(3-methoxy-3-methylpiperidin-1-yl)methyl]pyridine-2-carbohydrazide
PubChem CID107395824
Molecular FormulaC14H22N4O2
Molecular Weight278.36 g/mol
Exact Mass278.17
IUPAC Name6-[(3-methoxy-3-methylpiperidin-1-yl)methyl]pyridine-2-carbohydrazide
SMILESCOC1(C)CCCN(Cc2cccc(C(=O)NN)n2)C1
InChIInChI=1S/C14H22N4O2/c1-14(20-2)7-4-8-18(10-14)9-11-5-3-6-12(16-11)13(19)17-15/h3,5-6H,4,7-10,15H2,1-2H3,(H,17,19)
InChIKeyYJIFAWDYNCRBQT-UHFFFAOYSA-N
XLogP0.69
TPSA80.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 50.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-[[6-[(3-methoxy-3-methylpiperidin-1-yl)methyl]-2-pyridinyl]methyl]cyclopropanamine
CID 107395527
6-[(3-methylpiperidin-1-yl)methyl]pyridine-2-carbohydrazide
CID 106909015
3-[(3-methoxy-3-methylpiperidin-1-yl)methyl]thiophene-2-carbohydrazide
CID 107395848
6-[(4-hydroxypiperidin-1-yl)methyl]pyridine-2-carbohydrazide
CID 106909004
6-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]pyridine-2-carbohydrazide
CID 106908998
6-[(3-aminopyrrolidin-1-yl)methyl]pyridine-2-carbohydrazide
CID 106909083
6-[(3-hydroxypyrrolidin-1-yl)methyl]pyridine-2-carbohydrazide
CID 106909097
6-[(4-butan-2-ylpiperazin-1-yl)methyl]pyridine-2-carbohydrazide
CID 106909093
N-[1-[[6-(hydrazinecarbonyl)-2-pyridinyl]methyl]piperidin-4-yl]acetamide
CID 106909367
4-[(3-methoxy-3-methylpiperidin-1-yl)methyl]benzoic acid
CID 107393386
3-(3-methoxy-3-methylpiperidin-1-yl)propanehydrazide
CID 107395837
6-(piperidin-1-ylmethyl)pyridine-2-carboxamide
CID 66911251

Frequently Asked Questions

What is the IUPAC name of 6-[(3-methoxy-3-methylpiperidin-1-yl)methyl]pyridine-2-carbohydrazide?
The IUPAC name of 6-[(3-methoxy-3-methylpiperidin-1-yl)methyl]pyridine-2-carbohydrazide (CID 107395824) is 6-[(3-methoxy-3-methylpiperidin-1-yl)methyl]pyridine-2-carbohydrazide.
What is the SMILES notation for 6-[(3-methoxy-3-methylpiperidin-1-yl)methyl]pyridine-2-carbohydrazide?
The canonical SMILES for 6-[(3-methoxy-3-methylpiperidin-1-yl)methyl]pyridine-2-carbohydrazide is COC1(C)CCCN(Cc2cccc(C(=O)NN)n2)C1.
What is the InChIKey of 6-[(3-methoxy-3-methylpiperidin-1-yl)methyl]pyridine-2-carbohydrazide?
The InChIKey is YJIFAWDYNCRBQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O2/c1-14(20-2)7-4-8-18(10-14)9-11-5-3-6-12(16-11)13(19)17-15/h3,5-6H,4,7-10,15H2,1-2H3,(H,17,19).
What are the key properties of 6-[(3-methoxy-3-methylpiperidin-1-yl)methyl]pyridine-2-carbohydrazide?
6-[(3-methoxy-3-methylpiperidin-1-yl)methyl]pyridine-2-carbohydrazide has a molecular weight of 278.36 g/mol, XLogP of 0.69, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(3-methoxy-3-methylpiperidin-1-yl)methyl]pyridine-2-carbohydrazide is sourced from PubChem (CID 107395824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).