3-amino-N-(2-methyl-2-phenylpropyl)thiophene-2-carboxamide

C15H18N2OS — CID 61139791

IUPAC3-amino-N-(2-methyl-2-phenylpropyl)thiophene-2-carboxamide
SMILESCC(C)(CNC(=O)c1sccc1N)c1ccccc1
InChIInChI=1S/C15H18N2OS/c1-15(2,11-6-4-3-5-7-11)10-17-14(18)13-12(16)8-9-19-13/h3-9H,10,16H2,1-2H3,(H,17,18)
InChIKeyXLZOEODDZLNDAU-UHFFFAOYSA-N
MW274.39 g/mol
LogP3.04
Rot. Bonds4

About 3-amino-N-(2-methyl-2-phenylpropyl)thiophene-2-carboxamide

3-amino-N-(2-methyl-2-phenylpropyl)thiophene-2-carboxamide (PubChem CID 61139791) has the molecular formula C15H18N2OS and a molecular weight of 274.39 g/mol. Its IUPAC name is 3-amino-N-(2-methyl-2-phenylpropyl)thiophene-2-carboxamide.

Molecular Properties

Compound Name3-amino-N-(2-methyl-2-phenylpropyl)thiophene-2-carboxamide
PubChem CID61139791
Molecular FormulaC15H18N2OS
Molecular Weight274.39 g/mol
Exact Mass274.11
IUPAC Name3-amino-N-(2-methyl-2-phenylpropyl)thiophene-2-carboxamide
SMILESCC(C)(CNC(=O)c1sccc1N)c1ccccc1
InChIInChI=1S/C15H18N2OS/c1-15(2,11-6-4-3-5-7-11)10-17-14(18)13-12(16)8-9-19-13/h3-9H,10,16H2,1-2H3,(H,17,18)
InChIKeyXLZOEODDZLNDAU-UHFFFAOYSA-N
XLogP3.04
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.39
LogP ≤ 53.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-methyl-2-phenylpropyl)thiophene-2-carboxamide
CID 39698381
N-(2-methyl-2-phenylpropyl)-1,3-thiazole-2-carboxamide
CID 110467972
3-amino-N-(2,3,3-trimethylbutyl)thiophene-2-carboxamide
CID 83142073
N-(2-methyl-2-phenylpropyl)thiophene-3-carboxamide
CID 39700914
3-amino-N-(2,2,3,3-tetrafluoropropyl)thiophene-2-carboxamide
CID 106289141
N-(2-acetamidoethyl)-3-aminothiophene-2-carboxamide
CID 61092677
3-amino-4-methyl-N-(2-methyl-2-phenylpropyl)benzamide
CID 60987768
N-(2-hydroxy-2-phenylpropyl)-3-methylsulfanylthiophene-2-carboxamide
CID 111335113
3-bromo-N-[2-(3-bromophenyl)-2-methylpropyl]thiophene-2-carboxamide
CID 60621665
3-amino-N-[3-(tert-butylamino)-3-oxopropyl]thiophene-2-carboxamide
CID 113409472
3-amino-4-bromo-N-(2-methyl-2-phenylpropyl)benzamide
CID 61139412
1,1-dimethyl-3-(2-methyl-2-phenylpropyl)urea
CID 110459934

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(2-methyl-2-phenylpropyl)thiophene-2-carboxamide?
The IUPAC name of 3-amino-N-(2-methyl-2-phenylpropyl)thiophene-2-carboxamide (CID 61139791) is 3-amino-N-(2-methyl-2-phenylpropyl)thiophene-2-carboxamide.
What is the SMILES notation for 3-amino-N-(2-methyl-2-phenylpropyl)thiophene-2-carboxamide?
The canonical SMILES for 3-amino-N-(2-methyl-2-phenylpropyl)thiophene-2-carboxamide is CC(C)(CNC(=O)c1sccc1N)c1ccccc1.
What is the InChIKey of 3-amino-N-(2-methyl-2-phenylpropyl)thiophene-2-carboxamide?
The InChIKey is XLZOEODDZLNDAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2OS/c1-15(2,11-6-4-3-5-7-11)10-17-14(18)13-12(16)8-9-19-13/h3-9H,10,16H2,1-2H3,(H,17,18).
What are the key properties of 3-amino-N-(2-methyl-2-phenylpropyl)thiophene-2-carboxamide?
3-amino-N-(2-methyl-2-phenylpropyl)thiophene-2-carboxamide has a molecular weight of 274.39 g/mol, XLogP of 3.04, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2-methyl-2-phenylpropyl)thiophene-2-carboxamide is sourced from PubChem (CID 61139791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).