N-[1-[(2Z)-2-amino-2-hydroxyiminoethyl]piperidin-4-yl]-2-methoxyacetamide

C10H20N4O3 — CID 63625575

IUPACN-[1-[(2Z)-2-amino-2-hydroxyiminoethyl]piperidin-4-yl]-2-methoxyacetamide
SMILESCOCC(=O)NC1CCN(C/C(N)=N/O)CC1
InChIInChI=1S/C10H20N4O3/c1-17-7-10(15)12-8-2-4-14(5-3-8)6-9(11)13-16/h8,16H,2-7H2,1H3,(H2,11,13)(H,12,15)
InChIKeyBLOVCFAJYDAIOF-UHFFFAOYSA-N
MW244.29 g/mol
LogP-1.04
Rot. Bonds5

About N-[1-[(2Z)-2-amino-2-hydroxyiminoethyl]piperidin-4-yl]-2-methoxyacetamide

N-[1-[(2Z)-2-amino-2-hydroxyiminoethyl]piperidin-4-yl]-2-methoxyacetamide (PubChem CID 63625575) has the molecular formula C10H20N4O3 and a molecular weight of 244.29 g/mol. Its IUPAC name is N-[1-[(2Z)-2-amino-2-hydroxyiminoethyl]piperidin-4-yl]-2-methoxyacetamide.

Molecular Properties

Compound NameN-[1-[(2Z)-2-amino-2-hydroxyiminoethyl]piperidin-4-yl]-2-methoxyacetamide
PubChem CID63625575
Molecular FormulaC10H20N4O3
Molecular Weight244.29 g/mol
Exact Mass244.15
IUPAC NameN-[1-[(2Z)-2-amino-2-hydroxyiminoethyl]piperidin-4-yl]-2-methoxyacetamide
SMILESCOCC(=O)NC1CCN(C/C(N)=N/O)CC1
InChIInChI=1S/C10H20N4O3/c1-17-7-10(15)12-8-2-4-14(5-3-8)6-9(11)13-16/h8,16H,2-7H2,1H3,(H2,11,13)(H,12,15)
InChIKeyBLOVCFAJYDAIOF-UHFFFAOYSA-N
XLogP-1.04
TPSA100.18 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 5-1.04
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-[1-(2-amino-2-hydroxyiminoethyl)piperidin-4-yl]-2-(2,2,2-trifluoroethoxy)acetamide
CID 103211609
N-[(1Z)-1-amino-1-hydroxyiminopentan-3-yl]-2-methoxyacetamide
CID 55208859
N-[1-[(2Z)-2-amino-2-hydroxyiminoethyl]piperidin-4-yl]-2-ethoxyacetamide
CID 55249621
2-[(E)-(1-amino-2-morpholin-4-ylethylidene)amino]oxy-N-cyclohexyl-N-ethylacetamide
CID 60296409
2-[(E)-(1-amino-2-morpholin-4-ylethylidene)amino]oxy-N,N-di(propan-2-yl)acetamide
CID 60296447
2-[(Z)-(1-amino-2-morpholin-4-ylethylidene)amino]oxy-N-cyclopropylacetamide
CID 60296665
2-[(E)-[1-amino-2-(2-methylpiperidin-1-yl)ethylidene]amino]oxy-N,N-di(propan-2-yl)acetamide
CID 60297405
2-[(E)-[1-amino-2-(2-methylpiperidin-1-yl)ethylidene]amino]oxy-N-ethylacetamide
CID 60297441
N-[(1Z)-1-amino-1-hydroxyiminopentan-2-yl]-2-methoxyacetamide
CID 61278177
N-[4-[(Z)-N'-hydroxycarbamimidoyl]-1-methylpiperidin-4-yl]-2-methoxyacetamide
CID 61278379
3-amino-3-hydroxyimino-N-(1-morpholin-4-ylpropan-2-yl)propanamide
CID 61500768
N-[1-(2-aminoethyl)piperidin-4-yl]-2-methoxyacetamide
CID 63625582

Frequently Asked Questions

What is the IUPAC name of N-[1-[(2Z)-2-amino-2-hydroxyiminoethyl]piperidin-4-yl]-2-methoxyacetamide?
The IUPAC name of N-[1-[(2Z)-2-amino-2-hydroxyiminoethyl]piperidin-4-yl]-2-methoxyacetamide (CID 63625575) is N-[1-[(2Z)-2-amino-2-hydroxyiminoethyl]piperidin-4-yl]-2-methoxyacetamide.
What is the SMILES notation for N-[1-[(2Z)-2-amino-2-hydroxyiminoethyl]piperidin-4-yl]-2-methoxyacetamide?
The canonical SMILES for N-[1-[(2Z)-2-amino-2-hydroxyiminoethyl]piperidin-4-yl]-2-methoxyacetamide is COCC(=O)NC1CCN(C/C(N)=N/O)CC1.
What is the InChIKey of N-[1-[(2Z)-2-amino-2-hydroxyiminoethyl]piperidin-4-yl]-2-methoxyacetamide?
The InChIKey is BLOVCFAJYDAIOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N4O3/c1-17-7-10(15)12-8-2-4-14(5-3-8)6-9(11)13-16/h8,16H,2-7H2,1H3,(H2,11,13)(H,12,15).
What are the key properties of N-[1-[(2Z)-2-amino-2-hydroxyiminoethyl]piperidin-4-yl]-2-methoxyacetamide?
N-[1-[(2Z)-2-amino-2-hydroxyiminoethyl]piperidin-4-yl]-2-methoxyacetamide has a molecular weight of 244.29 g/mol, XLogP of -1.04, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[(2Z)-2-amino-2-hydroxyiminoethyl]piperidin-4-yl]-2-methoxyacetamide is sourced from PubChem (CID 63625575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).