3-phenyl-2-(2-thiophen-2-ylethylamino)propan-1-ol

C15H19NOS — CID 63775301

IUPAC3-phenyl-2-(2-thiophen-2-ylethylamino)propan-1-ol
SMILESOCC(Cc1ccccc1)NCCc1cccs1
InChIInChI=1S/C15H19NOS/c17-12-14(11-13-5-2-1-3-6-13)16-9-8-15-7-4-10-18-15/h1-7,10,14,16-17H,8-9,11-12H2
InChIKeyUQLYDAHMEQLRQQ-UHFFFAOYSA-N
MW261.39 g/mol
LogP2.48
Rot. Bonds7

About 3-phenyl-2-(2-thiophen-2-ylethylamino)propan-1-ol

3-phenyl-2-(2-thiophen-2-ylethylamino)propan-1-ol (PubChem CID 63775301) has the molecular formula C15H19NOS and a molecular weight of 261.39 g/mol. Its IUPAC name is 3-phenyl-2-(2-thiophen-2-ylethylamino)propan-1-ol.

Molecular Properties

Compound Name3-phenyl-2-(2-thiophen-2-ylethylamino)propan-1-ol
PubChem CID63775301
Molecular FormulaC15H19NOS
Molecular Weight261.39 g/mol
Exact Mass261.12
IUPAC Name3-phenyl-2-(2-thiophen-2-ylethylamino)propan-1-ol
SMILESOCC(Cc1ccccc1)NCCc1cccs1
InChIInChI=1S/C15H19NOS/c17-12-14(11-13-5-2-1-3-6-13)16-9-8-15-7-4-10-18-15/h1-7,10,14,16-17H,8-9,11-12H2
InChIKeyUQLYDAHMEQLRQQ-UHFFFAOYSA-N
XLogP2.48
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.39
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-phenyl-N-(2-thiophen-2-ylethyl)butan-2-amine
CID 79007188
(2R)-3-phenyl-2-(propylamino)propan-1-ol
CID 59859919
2-(3-methylsulfonylpropylamino)-3-phenylpropan-1-ol
CID 55168818
2-(heptylamino)-3-phenylpropan-1-ol
CID 63260589
N-benzyl-3-thiophen-2-ylpropan-1-amine
CID 83456686
2-(2-ethoxyethylamino)-3-phenylpropan-1-ol
CID 63261508
N-propyl-1-pyridin-4-yl-4-thiophen-2-ylbutan-2-amine
CID 63775624
2-[2-(4-methylpiperazin-1-yl)ethylamino]-3-phenylpropan-1-ol
CID 82889725
2-[(3-aminothiophen-2-yl)methylamino]-3-phenylpropan-1-ol
CID 66387003
(2R)-2-[(3-methylthiophen-2-yl)methylamino]-3-phenylpropan-1-ol
CID 104922908
methyl 4-[(1-hydroxy-3-phenylpropan-2-yl)amino]butanoate
CID 55169386
(2S)-2-(2-methylpropylamino)-3-phenylpropan-1-ol
CID 102610095

Frequently Asked Questions

What is the IUPAC name of 3-phenyl-2-(2-thiophen-2-ylethylamino)propan-1-ol?
The IUPAC name of 3-phenyl-2-(2-thiophen-2-ylethylamino)propan-1-ol (CID 63775301) is 3-phenyl-2-(2-thiophen-2-ylethylamino)propan-1-ol.
What is the SMILES notation for 3-phenyl-2-(2-thiophen-2-ylethylamino)propan-1-ol?
The canonical SMILES for 3-phenyl-2-(2-thiophen-2-ylethylamino)propan-1-ol is OCC(Cc1ccccc1)NCCc1cccs1.
What is the InChIKey of 3-phenyl-2-(2-thiophen-2-ylethylamino)propan-1-ol?
The InChIKey is UQLYDAHMEQLRQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NOS/c17-12-14(11-13-5-2-1-3-6-13)16-9-8-15-7-4-10-18-15/h1-7,10,14,16-17H,8-9,11-12H2.
What are the key properties of 3-phenyl-2-(2-thiophen-2-ylethylamino)propan-1-ol?
3-phenyl-2-(2-thiophen-2-ylethylamino)propan-1-ol has a molecular weight of 261.39 g/mol, XLogP of 2.48, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenyl-2-(2-thiophen-2-ylethylamino)propan-1-ol is sourced from PubChem (CID 63775301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).