N-(2-amino-2-hydroxyiminoethyl)-2-(3-ethoxycyclobutyl)acetamide

C10H19N3O3 — CID 103166100

IUPACN-(2-amino-2-hydroxyiminoethyl)-2-(3-ethoxycyclobutyl)acetamide
SMILESCCOC1CC(CC(=O)NCC(N)=NO)C1
InChIInChI=1S/C10H19N3O3/c1-2-16-8-3-7(4-8)5-10(14)12-6-9(11)13-15/h7-8,15H,2-6H2,1H3,(H2,11,13)(H,12,14)
InChIKeyMGDRMTRGDNQCIL-UHFFFAOYSA-N
MW229.28 g/mol
LogP0.05
Rot. Bonds6

About N-(2-amino-2-hydroxyiminoethyl)-2-(3-ethoxycyclobutyl)acetamide

N-(2-amino-2-hydroxyiminoethyl)-2-(3-ethoxycyclobutyl)acetamide (PubChem CID 103166100) has the molecular formula C10H19N3O3 and a molecular weight of 229.28 g/mol. Its IUPAC name is N-(2-amino-2-hydroxyiminoethyl)-2-(3-ethoxycyclobutyl)acetamide.

Molecular Properties

Compound NameN-(2-amino-2-hydroxyiminoethyl)-2-(3-ethoxycyclobutyl)acetamide
PubChem CID103166100
Molecular FormulaC10H19N3O3
Molecular Weight229.28 g/mol
Exact Mass229.14
IUPAC NameN-(2-amino-2-hydroxyiminoethyl)-2-(3-ethoxycyclobutyl)acetamide
SMILESCCOC1CC(CC(=O)NCC(N)=NO)C1
InChIInChI=1S/C10H19N3O3/c1-2-16-8-3-7(4-8)5-10(14)12-6-9(11)13-15/h7-8,15H,2-6H2,1H3,(H2,11,13)(H,12,14)
InChIKeyMGDRMTRGDNQCIL-UHFFFAOYSA-N
XLogP0.05
TPSA96.94 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 50.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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

2-[[2-(3-ethoxycyclobutyl)acetyl]amino]acetic acid
CID 103161702
2-(3-ethoxycyclobutyl)-N-[2-(N'-hydroxycarbamimidoyl)cyclopentyl]acetamide
CID 103166142
N-[(4-chlorocyclohexyl)methyl]-2-(3-ethoxycyclobutyl)acetamide
CID 114147988
N-(3-chloropropyl)-2-(3-ethoxycyclobutyl)acetamide
CID 103164383
2-(3-ethoxycyclobutyl)-N-[4-[(Z)-N'-hydroxycarbamimidoyl]phenyl]acetamide
CID 103166077
N'-amino-2-(3-ethoxycyclobutyl)ethanimidamide
CID 103166323
2-(3-ethoxycyclobutyl)-N-[2-(methylamino)propyl]acetamide
CID 103512576
2-(3-ethoxycyclobutyl)-N-(1H-1,2,4-triazol-5-ylmethyl)acetamide
CID 103164811
N-[3-(2-bromoethoxy)propyl]-2-(3-ethoxycyclobutyl)acetamide
CID 106307815
2-(3-ethoxycyclobutyl)-N-(2-hydroxypentyl)acetamide
CID 103164764
5-[[2-(3-ethoxycyclobutyl)acetyl]amino]pentanoic acid
CID 103161944
N-(3-azidopropyl)-2-(3-ethoxycyclobutyl)acetamide
CID 103166301

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-hydroxyiminoethyl)-2-(3-ethoxycyclobutyl)acetamide?
The IUPAC name of N-(2-amino-2-hydroxyiminoethyl)-2-(3-ethoxycyclobutyl)acetamide (CID 103166100) is N-(2-amino-2-hydroxyiminoethyl)-2-(3-ethoxycyclobutyl)acetamide.
What is the SMILES notation for N-(2-amino-2-hydroxyiminoethyl)-2-(3-ethoxycyclobutyl)acetamide?
The canonical SMILES for N-(2-amino-2-hydroxyiminoethyl)-2-(3-ethoxycyclobutyl)acetamide is CCOC1CC(CC(=O)NCC(N)=NO)C1.
What is the InChIKey of N-(2-amino-2-hydroxyiminoethyl)-2-(3-ethoxycyclobutyl)acetamide?
The InChIKey is MGDRMTRGDNQCIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O3/c1-2-16-8-3-7(4-8)5-10(14)12-6-9(11)13-15/h7-8,15H,2-6H2,1H3,(H2,11,13)(H,12,14).
What are the key properties of N-(2-amino-2-hydroxyiminoethyl)-2-(3-ethoxycyclobutyl)acetamide?
N-(2-amino-2-hydroxyiminoethyl)-2-(3-ethoxycyclobutyl)acetamide has a molecular weight of 229.28 g/mol, XLogP of 0.05, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-hydroxyiminoethyl)-2-(3-ethoxycyclobutyl)acetamide is sourced from PubChem (CID 103166100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).