2-[1-[[2-(hydrazinecarbonyl)furan-3-yl]methyl]piperidin-4-yl]acetamide

C13H20N4O3 — CID 63578815

IUPAC2-[1-[[2-(hydrazinecarbonyl)furan-3-yl]methyl]piperidin-4-yl]acetamide
SMILESNNC(=O)c1occc1CN1CCC(CC(N)=O)CC1
InChIInChI=1S/C13H20N4O3/c14-11(18)7-9-1-4-17(5-2-9)8-10-3-6-20-12(10)13(19)16-15/h3,6,9H,1-2,4-5,7-8,15H2,(H2,14,18)(H,16,19)
InChIKeyZUMGLYHTWJWNRL-UHFFFAOYSA-N
MW280.33 g/mol
LogP-0.03
Rot. Bonds5

About 2-[1-[[2-(hydrazinecarbonyl)furan-3-yl]methyl]piperidin-4-yl]acetamide

2-[1-[[2-(hydrazinecarbonyl)furan-3-yl]methyl]piperidin-4-yl]acetamide (PubChem CID 63578815) has the molecular formula C13H20N4O3 and a molecular weight of 280.33 g/mol. Its IUPAC name is 2-[1-[[2-(hydrazinecarbonyl)furan-3-yl]methyl]piperidin-4-yl]acetamide.

Molecular Properties

Compound Name2-[1-[[2-(hydrazinecarbonyl)furan-3-yl]methyl]piperidin-4-yl]acetamide
PubChem CID63578815
Molecular FormulaC13H20N4O3
Molecular Weight280.33 g/mol
Exact Mass280.15
IUPAC Name2-[1-[[2-(hydrazinecarbonyl)furan-3-yl]methyl]piperidin-4-yl]acetamide
SMILESNNC(=O)c1occc1CN1CCC(CC(N)=O)CC1
InChIInChI=1S/C13H20N4O3/c14-11(18)7-9-1-4-17(5-2-9)8-10-3-6-20-12(10)13(19)16-15/h3,6,9H,1-2,4-5,7-8,15H2,(H2,14,18)(H,16,19)
InChIKeyZUMGLYHTWJWNRL-UHFFFAOYSA-N
XLogP-0.03
TPSA114.59 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.33
LogP ≤ 5-0.03
H-Bond Donors ≤ 53
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

3-[(4-hydroxypiperidin-1-yl)methyl]furan-2-carbohydrazide
CID 63570591
3-[(4-propylpiperidin-1-yl)methyl]furan-2-carbohydrazide
CID 63572820
3-(piperidin-1-ylmethyl)furan-2-carbohydrazide
CID 63568851
3-[(4-hydroxy-3-methylpiperidin-1-yl)methyl]furan-2-carbohydrazide
CID 114683794
3-[(3,4-dimethylpyrrolidin-1-yl)methyl]furan-2-carbohydrazide
CID 79184345
2-[1-[[5-(hydrazinecarbonyl)-2-methylfuran-3-yl]methyl]piperidin-4-yl]acetamide
CID 63579534
3-[(3-propoxypiperidin-1-yl)methyl]furan-2-carbohydrazide
CID 63578962
3-[(2-ethylpiperidin-1-yl)methyl]furan-2-carbohydrazide
CID 63572129
2-[1-[[4-(hydrazinecarbonyl)-5-methylfuran-2-yl]methyl]piperidin-4-yl]acetamide
CID 63579170
3-[[4-(2-phenylethyl)piperidin-1-yl]methyl]furan-2-carboxylic acid
CID 167982801
methyl 2-[[4-(2-amino-2-oxoethyl)piperidin-1-yl]methyl]benzoate
CID 82957081
3-[[methyl-[(1-methylpyrrolidin-3-yl)methyl]amino]methyl]furan-2-carbohydrazide
CID 63572264

Frequently Asked Questions

What is the IUPAC name of 2-[1-[[2-(hydrazinecarbonyl)furan-3-yl]methyl]piperidin-4-yl]acetamide?
The IUPAC name of 2-[1-[[2-(hydrazinecarbonyl)furan-3-yl]methyl]piperidin-4-yl]acetamide (CID 63578815) is 2-[1-[[2-(hydrazinecarbonyl)furan-3-yl]methyl]piperidin-4-yl]acetamide.
What is the SMILES notation for 2-[1-[[2-(hydrazinecarbonyl)furan-3-yl]methyl]piperidin-4-yl]acetamide?
The canonical SMILES for 2-[1-[[2-(hydrazinecarbonyl)furan-3-yl]methyl]piperidin-4-yl]acetamide is NNC(=O)c1occc1CN1CCC(CC(N)=O)CC1.
What is the InChIKey of 2-[1-[[2-(hydrazinecarbonyl)furan-3-yl]methyl]piperidin-4-yl]acetamide?
The InChIKey is ZUMGLYHTWJWNRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O3/c14-11(18)7-9-1-4-17(5-2-9)8-10-3-6-20-12(10)13(19)16-15/h3,6,9H,1-2,4-5,7-8,15H2,(H2,14,18)(H,16,19).
What are the key properties of 2-[1-[[2-(hydrazinecarbonyl)furan-3-yl]methyl]piperidin-4-yl]acetamide?
2-[1-[[2-(hydrazinecarbonyl)furan-3-yl]methyl]piperidin-4-yl]acetamide has a molecular weight of 280.33 g/mol, XLogP of -0.03, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[[2-(hydrazinecarbonyl)furan-3-yl]methyl]piperidin-4-yl]acetamide is sourced from PubChem (CID 63578815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).