2-amino-N-(1,1-dimethoxypropan-2-yl)-2-thiophen-2-ylacetamide

C11H18N2O3S — CID 115287355

IUPAC2-amino-N-(1,1-dimethoxypropan-2-yl)-2-thiophen-2-ylacetamide
SMILESCOC(OC)C(C)NC(=O)C(N)c1cccs1
InChIInChI=1S/C11H18N2O3S/c1-7(11(15-2)16-3)13-10(14)9(12)8-5-4-6-17-8/h4-7,9,11H,12H2,1-3H3,(H,13,14)
InChIKeySCQANFVWDXIVQI-UHFFFAOYSA-N
MW258.34 g/mol
LogP0.87
Rot. Bonds6

About 2-amino-N-(1,1-dimethoxypropan-2-yl)-2-thiophen-2-ylacetamide

2-amino-N-(1,1-dimethoxypropan-2-yl)-2-thiophen-2-ylacetamide (PubChem CID 115287355) has the molecular formula C11H18N2O3S and a molecular weight of 258.34 g/mol. Its IUPAC name is 2-amino-N-(1,1-dimethoxypropan-2-yl)-2-thiophen-2-ylacetamide.

Molecular Properties

Compound Name2-amino-N-(1,1-dimethoxypropan-2-yl)-2-thiophen-2-ylacetamide
PubChem CID115287355
Molecular FormulaC11H18N2O3S
Molecular Weight258.34 g/mol
Exact Mass258.10
IUPAC Name2-amino-N-(1,1-dimethoxypropan-2-yl)-2-thiophen-2-ylacetamide
SMILESCOC(OC)C(C)NC(=O)C(N)c1cccs1
InChIInChI=1S/C11H18N2O3S/c1-7(11(15-2)16-3)13-10(14)9(12)8-5-4-6-17-8/h4-7,9,11H,12H2,1-3H3,(H,13,14)
InChIKeySCQANFVWDXIVQI-UHFFFAOYSA-N
XLogP0.87
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.34
LogP ≤ 50.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Analyze 2-amino-N-(1,1-dimethoxypropan-2-yl)-2-thiophen-2-ylacetamide 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

methyl 2-[(2-amino-2-thiophen-2-ylacetyl)amino]-4-methylpentanoate
CID 115286243
methyl (2S)-2-[(2-amino-2-thiophen-2-ylacetyl)amino]-4-methylpentanoate
CID 103954898
2-amino-N-(1-hydroxypropan-2-yl)-2-thiophen-2-ylacetamide
CID 115286053
2-amino-N-(2-methoxypropyl)-2-thiophen-2-ylacetamide
CID 102695079
(2S)-2-[(2-amino-2-thiophen-2-ylacetyl)amino]-3-methylbutanoic acid
CID 115286900
2-amino-N-(1-ethoxypropan-2-yl)-2-thiophen-2-ylacetamide
CID 115287106
2-amino-N-(1,1-dimethoxypropan-2-yl)-2-(4-methylphenyl)acetamide
CID 106312416
2-amino-N-(1,3-dihydroxypropan-2-yl)-2-thiophen-2-ylacetamide
CID 115287404
2-[(2-amino-2-thiophen-2-ylacetyl)amino]-4-methylpentanoic acid
CID 113279146
2-amino-N-[4-(dimethylamino)butan-2-yl]-2-thiophen-2-ylacetamide
CID 113279191
2-[(2-amino-2-thiophen-2-ylacetyl)amino]-5-methoxy-5-oxopentanoic acid
CID 82786809
2-amino-N-(2-methylpropyl)-2-thiophen-2-ylacetamide
CID 115285812

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(1,1-dimethoxypropan-2-yl)-2-thiophen-2-ylacetamide?
The IUPAC name of 2-amino-N-(1,1-dimethoxypropan-2-yl)-2-thiophen-2-ylacetamide (CID 115287355) is 2-amino-N-(1,1-dimethoxypropan-2-yl)-2-thiophen-2-ylacetamide.
What is the SMILES notation for 2-amino-N-(1,1-dimethoxypropan-2-yl)-2-thiophen-2-ylacetamide?
The canonical SMILES for 2-amino-N-(1,1-dimethoxypropan-2-yl)-2-thiophen-2-ylacetamide is COC(OC)C(C)NC(=O)C(N)c1cccs1.
What is the InChIKey of 2-amino-N-(1,1-dimethoxypropan-2-yl)-2-thiophen-2-ylacetamide?
The InChIKey is SCQANFVWDXIVQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O3S/c1-7(11(15-2)16-3)13-10(14)9(12)8-5-4-6-17-8/h4-7,9,11H,12H2,1-3H3,(H,13,14).
What are the key properties of 2-amino-N-(1,1-dimethoxypropan-2-yl)-2-thiophen-2-ylacetamide?
2-amino-N-(1,1-dimethoxypropan-2-yl)-2-thiophen-2-ylacetamide has a molecular weight of 258.34 g/mol, XLogP of 0.87, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(1,1-dimethoxypropan-2-yl)-2-thiophen-2-ylacetamide is sourced from PubChem (CID 115287355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).