N-(1-cyclopropylpropan-2-ylideneamino)-2-trimethylstannylacetamide

C11H22N2OSn — CID 154476267

IUPACN-(1-cyclopropylpropan-2-ylideneamino)-2-trimethylstannylacetamide
SMILESCC(CC1CC1)=NNC(=O)C[Sn](C)(C)C
InChIInChI=1S/C8H13N2O.3CH3.Sn/c1-6(5-8-3-4-8)9-10-7(2)11;;;;/h8H,2-5H2,1H3,(H,10,11);3*1H3;
InChIKeyIFVJRICUIXFHPW-UHFFFAOYSA-N
MW317.02 g/mol
LogP2.62
Rot. Bonds5

About N-(1-cyclopropylpropan-2-ylideneamino)-2-trimethylstannylacetamide

N-(1-cyclopropylpropan-2-ylideneamino)-2-trimethylstannylacetamide (PubChem CID 154476267) has the molecular formula C11H22N2OSn and a molecular weight of 317.02 g/mol. Its IUPAC name is N-(1-cyclopropylpropan-2-ylideneamino)-2-trimethylstannylacetamide.

Molecular Properties

Compound NameN-(1-cyclopropylpropan-2-ylideneamino)-2-trimethylstannylacetamide
PubChem CID154476267
Molecular FormulaC11H22N2OSn
Molecular Weight317.02 g/mol
Exact Mass318.08
IUPAC NameN-(1-cyclopropylpropan-2-ylideneamino)-2-trimethylstannylacetamide
SMILESCC(CC1CC1)=NNC(=O)C[Sn](C)(C)C
InChIInChI=1S/C8H13N2O.3CH3.Sn/c1-6(5-8-3-4-8)9-10-7(2)11;;;;/h8H,2-5H2,1H3,(H,10,11);3*1H3;
InChIKeyIFVJRICUIXFHPW-UHFFFAOYSA-N
XLogP2.62
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.02
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3,3-dimethyl-1-[4-(2-oxopropyl)cyclohexyl]butan-2-one
CID 21340947
1-cyclopropyl-4-(methylamino)butan-2-one
CID 116561221
N-(1-cyclopentylpropan-2-ylidene)hydroxylamine
CID 131143406
(E)-3-[[4-[(E)-2-acetyl-3-hydroxybut-2-enyl]cyclohexyl]methyl]-4-hydroxypent-3-en-2-one
CID 6993330
2-cyclopropyl-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]acetamide
CID 79252136
1-cyclopropyl-4,4-dimethylpentan-2-one
CID 58286843
2-cyclobutyl-N-methylacetamide
CID 57296172
N-(2-acetamidoethyl)-2-(4-aminocyclohexyl)acetamide
CID 55117197
N-[(E)-4-methylpentan-2-ylideneamino]cyclopropanecarboxamide
CID 19685374
2-[(3R)-1,1-dioxothiolan-3-yl]-N-[(Z)-1-phenylethylideneamino]acetamide
CID 8865960
N-methyl-4-[2-(methylamino)-2-oxoethyl]cyclohexane-1-carboxamide
CID 155198720
(Z)-N-methoxy-1-(4-methylcyclohexyl)propan-2-imine
CID 143498332

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylpropan-2-ylideneamino)-2-trimethylstannylacetamide?
The IUPAC name of N-(1-cyclopropylpropan-2-ylideneamino)-2-trimethylstannylacetamide (CID 154476267) is N-(1-cyclopropylpropan-2-ylideneamino)-2-trimethylstannylacetamide.
What is the SMILES notation for N-(1-cyclopropylpropan-2-ylideneamino)-2-trimethylstannylacetamide?
The canonical SMILES for N-(1-cyclopropylpropan-2-ylideneamino)-2-trimethylstannylacetamide is CC(CC1CC1)=NNC(=O)C[Sn](C)(C)C.
What is the InChIKey of N-(1-cyclopropylpropan-2-ylideneamino)-2-trimethylstannylacetamide?
The InChIKey is IFVJRICUIXFHPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N2O.3CH3.Sn/c1-6(5-8-3-4-8)9-10-7(2)11;;;;/h8H,2-5H2,1H3,(H,10,11);3*1H3;.
What are the key properties of N-(1-cyclopropylpropan-2-ylideneamino)-2-trimethylstannylacetamide?
N-(1-cyclopropylpropan-2-ylideneamino)-2-trimethylstannylacetamide has a molecular weight of 317.02 g/mol, XLogP of 2.62, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylpropan-2-ylideneamino)-2-trimethylstannylacetamide is sourced from PubChem (CID 154476267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).