3-amino-3-hydroxyimino-N-(1-methylcyclobutyl)propanamide

C8H15N3O2 — CID 104865832

IUPAC3-amino-3-hydroxyimino-N-(1-methylcyclobutyl)propanamide
SMILESCC1(NC(=O)CC(N)=NO)CCC1
InChIInChI=1S/C8H15N3O2/c1-8(3-2-4-8)10-7(12)5-6(9)11-13/h13H,2-5H2,1H3,(H2,9,11)(H,10,12)
InChIKeyAYCKIJWDXDIYTK-UHFFFAOYSA-N
MW185.23 g/mol
LogP0.18
Rot. Bonds3

About 3-amino-3-hydroxyimino-N-(1-methylcyclobutyl)propanamide

3-amino-3-hydroxyimino-N-(1-methylcyclobutyl)propanamide (PubChem CID 104865832) has the molecular formula C8H15N3O2 and a molecular weight of 185.23 g/mol. Its IUPAC name is 3-amino-3-hydroxyimino-N-(1-methylcyclobutyl)propanamide.

Molecular Properties

Compound Name3-amino-3-hydroxyimino-N-(1-methylcyclobutyl)propanamide
PubChem CID104865832
Molecular FormulaC8H15N3O2
Molecular Weight185.23 g/mol
Exact Mass185.12
IUPAC Name3-amino-3-hydroxyimino-N-(1-methylcyclobutyl)propanamide
SMILESCC1(NC(=O)CC(N)=NO)CCC1
InChIInChI=1S/C8H15N3O2/c1-8(3-2-4-8)10-7(12)5-6(9)11-13/h13H,2-5H2,1H3,(H2,9,11)(H,10,12)
InChIKeyAYCKIJWDXDIYTK-UHFFFAOYSA-N
XLogP0.18
TPSA87.71 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.23
LogP ≤ 50.18
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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'}

Analyze 3-amino-3-hydroxyimino-N-(1-methylcyclobutyl)propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-amino-3-hydroxyimino-N-(1-methylcyclopentyl)propanamide
CID 77051955
3-amino-3-hydroxyimino-N-(1-methylcyclopropyl)propanamide
CID 104865818
N-(1-methylcyclobutyl)propanamide
CID 115766065
2-(1-aminocyclopentyl)-N-(1-methylcyclopentyl)acetamide
CID 64677004
N'-hydroxy-3-[(1-methylcyclobutyl)amino]butanimidamide
CID 104865748
1-(N'-hydroxycarbamimidoyl)-N-(1-methylcyclohexyl)cyclopropane-1-carboxamide
CID 80597111
3-[[1-(2-amino-2-hydroxyiminoethyl)cyclopropyl]methylamino]-N-propan-2-ylpropanamide
CID 113410658
4-(N'-hydroxycarbamimidoyl)-N-(1-methylcyclobutyl)oxane-4-carboxamide
CID 113485856
2-[1-[2-[(1-methylcyclobutyl)amino]-2-oxoethyl]cyclohexyl]acetic acid
CID 113485316
3-amino-3-hydroxyimino-2-methyl-N-(1-methylcyclohexyl)propanamide
CID 76927375
N'-hydroxy-2-[1-[[(1-methylcyclohexyl)amino]methyl]cyclopropyl]ethanimidamide
CID 77070818
3-hydrazinyl-N'-hydroxy-3-oxopropanimidamide
CID 2777210

Frequently Asked Questions

What is the IUPAC name of 3-amino-3-hydroxyimino-N-(1-methylcyclobutyl)propanamide?
The IUPAC name of 3-amino-3-hydroxyimino-N-(1-methylcyclobutyl)propanamide (CID 104865832) is 3-amino-3-hydroxyimino-N-(1-methylcyclobutyl)propanamide.
What is the SMILES notation for 3-amino-3-hydroxyimino-N-(1-methylcyclobutyl)propanamide?
The canonical SMILES for 3-amino-3-hydroxyimino-N-(1-methylcyclobutyl)propanamide is CC1(NC(=O)CC(N)=NO)CCC1.
What is the InChIKey of 3-amino-3-hydroxyimino-N-(1-methylcyclobutyl)propanamide?
The InChIKey is AYCKIJWDXDIYTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3O2/c1-8(3-2-4-8)10-7(12)5-6(9)11-13/h13H,2-5H2,1H3,(H2,9,11)(H,10,12).
What are the key properties of 3-amino-3-hydroxyimino-N-(1-methylcyclobutyl)propanamide?
3-amino-3-hydroxyimino-N-(1-methylcyclobutyl)propanamide has a molecular weight of 185.23 g/mol, XLogP of 0.18, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-3-hydroxyimino-N-(1-methylcyclobutyl)propanamide is sourced from PubChem (CID 104865832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).