1-phenyl-2-(4-thiophen-2-ylphenyl)ethanamine

C18H17NS — CID 82542180

IUPAC1-phenyl-2-(4-thiophen-2-ylphenyl)ethanamine
SMILESNC(Cc1ccc(-c2cccs2)cc1)c1ccccc1
InChIInChI=1S/C18H17NS/c19-17(15-5-2-1-3-6-15)13-14-8-10-16(11-9-14)18-7-4-12-20-18/h1-12,17H,13,19H2
InChIKeySMBAQZNJPLCHCH-UHFFFAOYSA-N
MW279.41 g/mol
LogP4.66
Rot. Bonds4

About 1-phenyl-2-(4-thiophen-2-ylphenyl)ethanamine

1-phenyl-2-(4-thiophen-2-ylphenyl)ethanamine (PubChem CID 82542180) has the molecular formula C18H17NS and a molecular weight of 279.41 g/mol. Its IUPAC name is 1-phenyl-2-(4-thiophen-2-ylphenyl)ethanamine.

Molecular Properties

Compound Name1-phenyl-2-(4-thiophen-2-ylphenyl)ethanamine
PubChem CID82542180
Molecular FormulaC18H17NS
Molecular Weight279.41 g/mol
Exact Mass279.11
IUPAC Name1-phenyl-2-(4-thiophen-2-ylphenyl)ethanamine
SMILESNC(Cc1ccc(-c2cccs2)cc1)c1ccccc1
InChIInChI=1S/C18H17NS/c19-17(15-5-2-1-3-6-15)13-14-8-10-16(11-9-14)18-7-4-12-20-18/h1-12,17H,13,19H2
InChIKeySMBAQZNJPLCHCH-UHFFFAOYSA-N
XLogP4.66
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.41
LogP ≤ 54.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-2-amino-2-(4-thiophen-2-ylphenyl)ethanol
CID 66514267
3-amino-3-(4-thiophen-2-ylphenyl)propan-1-ol
CID 170875139
1-phenyl-2-pyridin-4-ylethanamine
CID 10465342
2-(4-chlorophenyl)-1-phenylethanamine;hydrochloride
CID 3052629
ethyl 2-amino-3-(4-thiophen-2-ylphenyl)propanoate;hydrochloride
CID 174360592
2-[4-(chloromethyl)phenyl]thiophene
CID 21186166
2-(4-thiophen-2-ylphenyl)acetaldehyde
CID 87498538
1-[3-(2-methylpropyl)phenyl]-2-phenylethanamine
CID 116543879
methyl (2S)-3-phenyl-2-(4-thiophen-2-ylphenoxy)propanoate
CID 11151915
(1R)-2-(4-methylphenyl)-1-(2-thiophen-2-yl-1,3-thiazol-4-yl)ethanamine
CID 118371345
1-(2-methyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)-2-phenylethanamine
CID 62733943
diphenyl-(4-thiophen-2-ylphenyl)sulfanium chloride
CID 172791723

Frequently Asked Questions

What is the IUPAC name of 1-phenyl-2-(4-thiophen-2-ylphenyl)ethanamine?
The IUPAC name of 1-phenyl-2-(4-thiophen-2-ylphenyl)ethanamine (CID 82542180) is 1-phenyl-2-(4-thiophen-2-ylphenyl)ethanamine.
What is the SMILES notation for 1-phenyl-2-(4-thiophen-2-ylphenyl)ethanamine?
The canonical SMILES for 1-phenyl-2-(4-thiophen-2-ylphenyl)ethanamine is NC(Cc1ccc(-c2cccs2)cc1)c1ccccc1.
What is the InChIKey of 1-phenyl-2-(4-thiophen-2-ylphenyl)ethanamine?
The InChIKey is SMBAQZNJPLCHCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17NS/c19-17(15-5-2-1-3-6-15)13-14-8-10-16(11-9-14)18-7-4-12-20-18/h1-12,17H,13,19H2.
What are the key properties of 1-phenyl-2-(4-thiophen-2-ylphenyl)ethanamine?
1-phenyl-2-(4-thiophen-2-ylphenyl)ethanamine has a molecular weight of 279.41 g/mol, XLogP of 4.66, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-2-(4-thiophen-2-ylphenyl)ethanamine is sourced from PubChem (CID 82542180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).