2-methyl-1-[5-(2-methylphenyl)thiophen-2-yl]propan-1-amine

C15H19NS — CID 43363500

IUPAC2-methyl-1-[5-(2-methylphenyl)thiophen-2-yl]propan-1-amine
SMILESCc1ccccc1-c1ccc(C(N)C(C)C)s1
InChIInChI=1S/C15H19NS/c1-10(2)15(16)14-9-8-13(17-14)12-7-5-4-6-11(12)3/h4-10,15H,16H2,1-3H3
InChIKeyNXGKJVKSERQBMG-UHFFFAOYSA-N
MW245.39 g/mol
LogP4.38
Rot. Bonds3

About 2-methyl-1-[5-(2-methylphenyl)thiophen-2-yl]propan-1-amine

2-methyl-1-[5-(2-methylphenyl)thiophen-2-yl]propan-1-amine (PubChem CID 43363500) has the molecular formula C15H19NS and a molecular weight of 245.39 g/mol. Its IUPAC name is 2-methyl-1-[5-(2-methylphenyl)thiophen-2-yl]propan-1-amine.

Molecular Properties

Compound Name2-methyl-1-[5-(2-methylphenyl)thiophen-2-yl]propan-1-amine
PubChem CID43363500
Molecular FormulaC15H19NS
Molecular Weight245.39 g/mol
Exact Mass245.12
IUPAC Name2-methyl-1-[5-(2-methylphenyl)thiophen-2-yl]propan-1-amine
SMILESCc1ccccc1-c1ccc(C(N)C(C)C)s1
InChIInChI=1S/C15H19NS/c1-10(2)15(16)14-9-8-13(17-14)12-7-5-4-6-11(12)3/h4-10,15H,16H2,1-3H3
InChIKeyNXGKJVKSERQBMG-UHFFFAOYSA-N
XLogP4.38
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.39
LogP ≤ 54.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[5-(2,3-dichlorophenyl)thiophen-2-yl]-2-methylpropan-1-amine
CID 43154444
2-amino-1-[5-(2-methylphenyl)thiophen-2-yl]ethanol
CID 82116281
1-[5-(3-fluoro-2-iodophenyl)thiophen-2-yl]-2-methylpropan-1-amine
CID 114260897
1-[5-(3,5-dimethylphenyl)thiophen-2-yl]-2-methylpropan-1-amine
CID 43154369
1-[5-(3-chloro-2-fluorophenyl)thiophen-2-yl]ethanamine
CID 43154483
3-[5-(2-chlorophenyl)thiophen-2-yl]butan-1-amine
CID 82542688
1-[5-(3,5-difluorophenyl)thiophen-2-yl]-2-methylpropan-1-amine
CID 43154231
1-[5-(3-bromo-5-methylphenyl)thiophen-2-yl]-2-methylpropan-1-amine
CID 107577065
2-methyl-1-[5-(2,4,6-tribromophenyl)thiophen-2-yl]propan-1-amine
CID 43331832
N-[cyclopropyl-[5-(2-methylphenyl)thiophen-2-yl]methyl]ethanamine
CID 43288356
4,7-bis[5-(2-methylphenyl)thiophen-2-yl]-2,1,3-benzothiadiazole
CID 58610797
1-[5-(3-bromo-4-iodophenyl)thiophen-2-yl]-2-methylpropan-1-amine
CID 114262318

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-[5-(2-methylphenyl)thiophen-2-yl]propan-1-amine?
The IUPAC name of 2-methyl-1-[5-(2-methylphenyl)thiophen-2-yl]propan-1-amine (CID 43363500) is 2-methyl-1-[5-(2-methylphenyl)thiophen-2-yl]propan-1-amine.
What is the SMILES notation for 2-methyl-1-[5-(2-methylphenyl)thiophen-2-yl]propan-1-amine?
The canonical SMILES for 2-methyl-1-[5-(2-methylphenyl)thiophen-2-yl]propan-1-amine is Cc1ccccc1-c1ccc(C(N)C(C)C)s1.
What is the InChIKey of 2-methyl-1-[5-(2-methylphenyl)thiophen-2-yl]propan-1-amine?
The InChIKey is NXGKJVKSERQBMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NS/c1-10(2)15(16)14-9-8-13(17-14)12-7-5-4-6-11(12)3/h4-10,15H,16H2,1-3H3.
What are the key properties of 2-methyl-1-[5-(2-methylphenyl)thiophen-2-yl]propan-1-amine?
2-methyl-1-[5-(2-methylphenyl)thiophen-2-yl]propan-1-amine has a molecular weight of 245.39 g/mol, XLogP of 4.38, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-[5-(2-methylphenyl)thiophen-2-yl]propan-1-amine is sourced from PubChem (CID 43363500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).