2-[(2,2-dimethyl-1-thiophen-2-ylpropyl)amino]-N-methyl-N-phenylacetamide

C18H24N2OS — CID 60524516

IUPAC2-[(2,2-dimethyl-1-thiophen-2-ylpropyl)amino]-N-methyl-N-phenylacetamide
SMILESCN(C(=O)CNC(c1cccs1)C(C)(C)C)c1ccccc1
InChIInChI=1S/C18H24N2OS/c1-18(2,3)17(15-11-8-12-22-15)19-13-16(21)20(4)14-9-6-5-7-10-14/h5-12,17,19H,13H2,1-4H3
InChIKeyBFRNZPOPIGIULZ-UHFFFAOYSA-N
MW316.47 g/mol
LogP4.09
Rot. Bonds5

About 2-[(2,2-dimethyl-1-thiophen-2-ylpropyl)amino]-N-methyl-N-phenylacetamide

2-[(2,2-dimethyl-1-thiophen-2-ylpropyl)amino]-N-methyl-N-phenylacetamide (PubChem CID 60524516) has the molecular formula C18H24N2OS and a molecular weight of 316.47 g/mol. Its IUPAC name is 2-[(2,2-dimethyl-1-thiophen-2-ylpropyl)amino]-N-methyl-N-phenylacetamide.

Molecular Properties

Compound Name2-[(2,2-dimethyl-1-thiophen-2-ylpropyl)amino]-N-methyl-N-phenylacetamide
PubChem CID60524516
Molecular FormulaC18H24N2OS
Molecular Weight316.47 g/mol
Exact Mass316.16
IUPAC Name2-[(2,2-dimethyl-1-thiophen-2-ylpropyl)amino]-N-methyl-N-phenylacetamide
SMILESCN(C(=O)CNC(c1cccs1)C(C)(C)C)c1ccccc1
InChIInChI=1S/C18H24N2OS/c1-18(2,3)17(15-11-8-12-22-15)19-13-16(21)20(4)14-9-6-5-7-10-14/h5-12,17,19H,13H2,1-4H3
InChIKeyBFRNZPOPIGIULZ-UHFFFAOYSA-N
XLogP4.09
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.47
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[(2,2-dimethyl-1-thiophen-2-ylpropyl)amino]-N-methyl-N-phenylacetamide 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

2-[[2-[(2,2-dimethyl-1-thiophen-2-ylpropyl)amino]acetyl]amino]-N-phenylbenzamide
CID 55859880
N-methyl-N-propan-2-yl-2-[[(1R)-1-thiophen-2-ylethyl]amino]acetamide
CID 81408875
1-[4-(2-chlorophenyl)sulfonylpiperazin-1-yl]-2-[(2,2-dimethyl-1-thiophen-2-ylpropyl)amino]ethanone
CID 55861422
N-[2-(N-methylanilino)-2-oxoethyl]-2,2-diphenylacetamide
CID 112996260
2-(2,6-dichloroanilino)-N-methyl-N-phenylacetamide
CID 109007260
N,4,4-trimethyl-3-oxo-N-phenylpentanamide
CID 134872382
[2-(N-methylanilino)-2-oxoethyl]-[(S)-(4-methylphenyl)-thiophen-2-ylmethyl]azanium
CID 8866978
N-[(1S)-2,2-dimethyl-1-thiophen-2-ylpropyl]-2-[(2-phenoxyacetyl)amino]acetamide
CID 94490347
N-methyl-4-oxo-N-phenyl-4-thiophen-2-ylbutanamide
CID 94102437
N-methyl-N-phenyl-2-(2,2,2-trifluoroethylamino)acetamide
CID 78914951
N-[2-(dimethylamino)-2-oxoethyl]-N-methyl-2-[[(R)-phenyl(thiophen-2-yl)methyl]amino]acetamide
CID 8863466
methyl 3-[[2-[(2,2-dimethyl-1-thiophen-2-ylpropyl)amino]acetyl]amino]-4-methylbenzoate
CID 55995427

Frequently Asked Questions

What is the IUPAC name of 2-[(2,2-dimethyl-1-thiophen-2-ylpropyl)amino]-N-methyl-N-phenylacetamide?
The IUPAC name of 2-[(2,2-dimethyl-1-thiophen-2-ylpropyl)amino]-N-methyl-N-phenylacetamide (CID 60524516) is 2-[(2,2-dimethyl-1-thiophen-2-ylpropyl)amino]-N-methyl-N-phenylacetamide.
What is the SMILES notation for 2-[(2,2-dimethyl-1-thiophen-2-ylpropyl)amino]-N-methyl-N-phenylacetamide?
The canonical SMILES for 2-[(2,2-dimethyl-1-thiophen-2-ylpropyl)amino]-N-methyl-N-phenylacetamide is CN(C(=O)CNC(c1cccs1)C(C)(C)C)c1ccccc1.
What is the InChIKey of 2-[(2,2-dimethyl-1-thiophen-2-ylpropyl)amino]-N-methyl-N-phenylacetamide?
The InChIKey is BFRNZPOPIGIULZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2OS/c1-18(2,3)17(15-11-8-12-22-15)19-13-16(21)20(4)14-9-6-5-7-10-14/h5-12,17,19H,13H2,1-4H3.
What are the key properties of 2-[(2,2-dimethyl-1-thiophen-2-ylpropyl)amino]-N-methyl-N-phenylacetamide?
2-[(2,2-dimethyl-1-thiophen-2-ylpropyl)amino]-N-methyl-N-phenylacetamide has a molecular weight of 316.47 g/mol, XLogP of 4.09, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2,2-dimethyl-1-thiophen-2-ylpropyl)amino]-N-methyl-N-phenylacetamide is sourced from PubChem (CID 60524516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).