bis(N-butan-2-ylidenehydroxylamine);N-(1-phenyl-1-silylbutan-2-ylidene)hydroxylamine

C18H33N3O3Si — CID 173213543

IUPACbis(N-butan-2-ylidenehydroxylamine);N-(1-phenyl-1-silylbutan-2-ylidene)hydroxylamine
SMILESCCC(=NO)C([SiH3])c1ccccc1.CCC(C)=NO.CCC(C)=NO
InChIInChI=1S/C10H15NOSi.2C4H9NO/c1-2-9(11-12)10(13)8-6-4-3-5-7-8;2*1-3-4(2)5-6/h3-7,10,12H,2H2,1,13H3;2*6H,3H2,1-2H3
InChIKeyGCETUOCYRNFEJH-UHFFFAOYSA-N
MW367.57 g/mol
LogP3.83
Rot. Bonds5

About bis(N-butan-2-ylidenehydroxylamine);N-(1-phenyl-1-silylbutan-2-ylidene)hydroxylamine

bis(N-butan-2-ylidenehydroxylamine);N-(1-phenyl-1-silylbutan-2-ylidene)hydroxylamine (PubChem CID 173213543) has the molecular formula C18H33N3O3Si and a molecular weight of 367.57 g/mol. Its IUPAC name is bis(N-butan-2-ylidenehydroxylamine);N-(1-phenyl-1-silylbutan-2-ylidene)hydroxylamine.

Molecular Properties

Compound Namebis(N-butan-2-ylidenehydroxylamine);N-(1-phenyl-1-silylbutan-2-ylidene)hydroxylamine
PubChem CID173213543
Molecular FormulaC18H33N3O3Si
Molecular Weight367.57 g/mol
Exact Mass367.23
IUPAC Namebis(N-butan-2-ylidenehydroxylamine);N-(1-phenyl-1-silylbutan-2-ylidene)hydroxylamine
SMILESCCC(=NO)C([SiH3])c1ccccc1.CCC(C)=NO.CCC(C)=NO
InChIInChI=1S/C10H15NOSi.2C4H9NO/c1-2-9(11-12)10(13)8-6-4-3-5-7-8;2*1-3-4(2)5-6/h3-7,10,12H,2H2,1,13H3;2*6H,3H2,1-2H3
InChIKeyGCETUOCYRNFEJH-UHFFFAOYSA-N
XLogP3.83
TPSA97.77 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.57
LogP ≤ 53.83
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze bis(N-butan-2-ylidenehydroxylamine);N-(1-phenyl-1-silylbutan-2-ylidene)hydroxylamine 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

N-butan-2-ylidenehydroxylamine;vanadium
CID 162258260
N-butan-2-ylidenehydroxylamine;carbonic acid
CID 87857804
1-phenyl-1-silylhexane-2,5-dione
CID 123145677
2-[benzyl(2-hydroxyiminopropyl)amino]-1-phenylethanol
CID 88812154
(NE)-N-butan-2-ylidenehydroxylamine;methoxymethane
CID 89392475
(2S)-2-[(E)-butan-2-ylideneamino]oxy-2-phenylacetic acid
CID 172965594
N-(1,4-diphenylpentan-3-ylidene)hydroxylamine
CID 71320973
butan-2-yl-(3-hydroxyimino-1-phenylbutyl)phosphinic acid
CID 169084802
(3-hydroxyimino-1-phenylbutyl)-propan-2-ylphosphinic acid
CID 169084814
N-[(1R)-2-(2-butan-2-ylidenehydrazinyl)-2-oxo-1-phenylethyl]benzamide
CID 7230019
N-(2-phenyl-2-silylpentan-3-ylidene)hydroxylamine
CID 173031990
N-[4-(N-methylanilino)butan-2-ylidene]hydroxylamine
CID 86738152

Frequently Asked Questions

What is the IUPAC name of bis(N-butan-2-ylidenehydroxylamine);N-(1-phenyl-1-silylbutan-2-ylidene)hydroxylamine?
The IUPAC name of bis(N-butan-2-ylidenehydroxylamine);N-(1-phenyl-1-silylbutan-2-ylidene)hydroxylamine (CID 173213543) is bis(N-butan-2-ylidenehydroxylamine);N-(1-phenyl-1-silylbutan-2-ylidene)hydroxylamine.
What is the SMILES notation for bis(N-butan-2-ylidenehydroxylamine);N-(1-phenyl-1-silylbutan-2-ylidene)hydroxylamine?
The canonical SMILES for bis(N-butan-2-ylidenehydroxylamine);N-(1-phenyl-1-silylbutan-2-ylidene)hydroxylamine is CCC(=NO)C([SiH3])c1ccccc1.CCC(C)=NO.CCC(C)=NO.
What is the InChIKey of bis(N-butan-2-ylidenehydroxylamine);N-(1-phenyl-1-silylbutan-2-ylidene)hydroxylamine?
The InChIKey is GCETUOCYRNFEJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NOSi.2C4H9NO/c1-2-9(11-12)10(13)8-6-4-3-5-7-8;2*1-3-4(2)5-6/h3-7,10,12H,2H2,1,13H3;2*6H,3H2,1-2H3.
What are the key properties of bis(N-butan-2-ylidenehydroxylamine);N-(1-phenyl-1-silylbutan-2-ylidene)hydroxylamine?
bis(N-butan-2-ylidenehydroxylamine);N-(1-phenyl-1-silylbutan-2-ylidene)hydroxylamine has a molecular weight of 367.57 g/mol, XLogP of 3.83, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for bis(N-butan-2-ylidenehydroxylamine);N-(1-phenyl-1-silylbutan-2-ylidene)hydroxylamine is sourced from PubChem (CID 173213543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).