2-amino-N-(2-methyl-1-thiophen-2-ylpropyl)-2-phenylpropanamide

C17H22N2OS — CID 62487540

IUPAC2-amino-N-(2-methyl-1-thiophen-2-ylpropyl)-2-phenylpropanamide
SMILESCC(C)C(NC(=O)C(C)(N)c1ccccc1)c1cccs1
InChIInChI=1S/C17H22N2OS/c1-12(2)15(14-10-7-11-21-14)19-16(20)17(3,18)13-8-5-4-6-9-13/h4-12,15H,18H2,1-3H3,(H,19,20)
InChIKeyMAHQWTNWHMHJMK-UHFFFAOYSA-N
MW302.44 g/mol
LogP3.44
Rot. Bonds5

About 2-amino-N-(2-methyl-1-thiophen-2-ylpropyl)-2-phenylpropanamide

2-amino-N-(2-methyl-1-thiophen-2-ylpropyl)-2-phenylpropanamide (PubChem CID 62487540) has the molecular formula C17H22N2OS and a molecular weight of 302.44 g/mol. Its IUPAC name is 2-amino-N-(2-methyl-1-thiophen-2-ylpropyl)-2-phenylpropanamide.

Molecular Properties

Compound Name2-amino-N-(2-methyl-1-thiophen-2-ylpropyl)-2-phenylpropanamide
PubChem CID62487540
Molecular FormulaC17H22N2OS
Molecular Weight302.44 g/mol
Exact Mass302.15
IUPAC Name2-amino-N-(2-methyl-1-thiophen-2-ylpropyl)-2-phenylpropanamide
SMILESCC(C)C(NC(=O)C(C)(N)c1ccccc1)c1cccs1
InChIInChI=1S/C17H22N2OS/c1-12(2)15(14-10-7-11-21-14)19-16(20)17(3,18)13-8-5-4-6-9-13/h4-12,15H,18H2,1-3H3,(H,19,20)
InChIKeyMAHQWTNWHMHJMK-UHFFFAOYSA-N
XLogP3.44
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.44
LogP ≤ 53.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(2-amino-2-phenylpropanoyl)amino]-2-thiophen-2-ylacetic acid
CID 115284689
2-amino-N-(3-methylbutan-2-yl)-2-phenylpropanamide;hydrochloride
CID 120586686
(2S)-2-[(2-amino-2-phenylpropanoyl)amino]propanoic acid
CID 78991003
1,3-bis(2-methyl-1-thiophen-2-ylpropyl)urea
CID 47023834
2-amino-N-(1-amino-1-oxopropan-2-yl)-2-phenylpropanamide
CID 62488756
2-amino-N-[(2S)-1-amino-1-oxopropan-2-yl]-2-phenylpropanamide
CID 120587567
2-(aminomethyl)-4,4-dimethyl-N-(2-methyl-1-thiophen-2-ylpropyl)pentanamide
CID 107471377
2-amino-N-[1-(furan-2-yl)ethyl]-2-phenylpropanamide
CID 55078587
2-bromo-3-methyl-N-(2-methyl-1-thiophen-2-ylpropyl)butanamide
CID 43699738
2-amino-N-(2-methyl-1-thiophen-2-ylpropyl)butanamide
CID 43709179
(2S)-2-amino-N-(2-methyl-1-thiophen-2-ylpropyl)butanamide
CID 79024579
(2R)-2-[(2-amino-2-phenylpropanoyl)amino]-4-methylpentanoic acid
CID 78991000

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2-methyl-1-thiophen-2-ylpropyl)-2-phenylpropanamide?
The IUPAC name of 2-amino-N-(2-methyl-1-thiophen-2-ylpropyl)-2-phenylpropanamide (CID 62487540) is 2-amino-N-(2-methyl-1-thiophen-2-ylpropyl)-2-phenylpropanamide.
What is the SMILES notation for 2-amino-N-(2-methyl-1-thiophen-2-ylpropyl)-2-phenylpropanamide?
The canonical SMILES for 2-amino-N-(2-methyl-1-thiophen-2-ylpropyl)-2-phenylpropanamide is CC(C)C(NC(=O)C(C)(N)c1ccccc1)c1cccs1.
What is the InChIKey of 2-amino-N-(2-methyl-1-thiophen-2-ylpropyl)-2-phenylpropanamide?
The InChIKey is MAHQWTNWHMHJMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2OS/c1-12(2)15(14-10-7-11-21-14)19-16(20)17(3,18)13-8-5-4-6-9-13/h4-12,15H,18H2,1-3H3,(H,19,20).
What are the key properties of 2-amino-N-(2-methyl-1-thiophen-2-ylpropyl)-2-phenylpropanamide?
2-amino-N-(2-methyl-1-thiophen-2-ylpropyl)-2-phenylpropanamide has a molecular weight of 302.44 g/mol, XLogP of 3.44, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2-methyl-1-thiophen-2-ylpropyl)-2-phenylpropanamide is sourced from PubChem (CID 62487540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).