1-(2-hydroxy-1-phenylethyl)-3-(2-thiophen-3-ylethyl)urea

C15H18N2O2S — CID 110895806

IUPAC1-(2-hydroxy-1-phenylethyl)-3-(2-thiophen-3-ylethyl)urea
SMILESO=C(NCCc1ccsc1)NC(CO)c1ccccc1
InChIInChI=1S/C15H18N2O2S/c18-10-14(13-4-2-1-3-5-13)17-15(19)16-8-6-12-7-9-20-11-12/h1-5,7,9,11,14,18H,6,8,10H2,(H2,16,17,19)
InChIKeyFMSLWMKTEQLAOP-UHFFFAOYSA-N
MW290.39 g/mol
LogP2.32
Rot. Bonds6

About 1-(2-hydroxy-1-phenylethyl)-3-(2-thiophen-3-ylethyl)urea

1-(2-hydroxy-1-phenylethyl)-3-(2-thiophen-3-ylethyl)urea (PubChem CID 110895806) has the molecular formula C15H18N2O2S and a molecular weight of 290.39 g/mol. Its IUPAC name is 1-(2-hydroxy-1-phenylethyl)-3-(2-thiophen-3-ylethyl)urea.

Molecular Properties

Compound Name1-(2-hydroxy-1-phenylethyl)-3-(2-thiophen-3-ylethyl)urea
PubChem CID110895806
Molecular FormulaC15H18N2O2S
Molecular Weight290.39 g/mol
Exact Mass290.11
IUPAC Name1-(2-hydroxy-1-phenylethyl)-3-(2-thiophen-3-ylethyl)urea
SMILESO=C(NCCc1ccsc1)NC(CO)c1ccccc1
InChIInChI=1S/C15H18N2O2S/c18-10-14(13-4-2-1-3-5-13)17-15(19)16-8-6-12-7-9-20-11-12/h1-5,7,9,11,14,18H,6,8,10H2,(H2,16,17,19)
InChIKeyFMSLWMKTEQLAOP-UHFFFAOYSA-N
XLogP2.32
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.39
LogP ≤ 52.32
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 1-(2-hydroxy-1-phenylethyl)-3-(2-thiophen-3-ylethyl)urea with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[2-(2-fluorophenyl)ethyl]-3-(2-hydroxy-1-phenylethyl)urea
CID 110895025
2-phenyl-3-(2-thiophen-3-ylethylamino)propanoic acid
CID 64561326
1-butyl-3-[(1R)-2-hydroxy-1-phenylethyl]urea
CID 94740192
4-[[(1R)-2-hydroxy-1-phenylethyl]carbamoylamino]butanoic acid
CID 122022193
(2R)-2-phenyl-2-(thiophen-3-ylmethylamino)ethanol
CID 103766360
(2S)-2-amino-3-phenyl-N-(2-thiophen-3-ylethyl)propanamide
CID 78971343
1-[(1S)-2-hydroxy-1-phenylethyl]-3-[2-(5-methyl-1,3-thiazol-2-yl)ethyl]urea
CID 97008326
1-hexyl-3-[(1R)-2-hydroxy-1-phenylethyl]urea
CID 59924188
1-[2-[benzyl(methyl)amino]ethyl]-3-(2-hydroxy-1-phenylethyl)urea
CID 110903342
4-methoxy-2-(2-thiophen-3-ylethylcarbamoylamino)butanoic acid
CID 55076436
(2R)-4-methylsulfanyl-2-(2-thiophen-3-ylethylcarbamoylamino)butanoic acid
CID 104910048
N-benzhydryl-2-thiophen-3-ylethanamine
CID 61474886

Frequently Asked Questions

What is the IUPAC name of 1-(2-hydroxy-1-phenylethyl)-3-(2-thiophen-3-ylethyl)urea?
The IUPAC name of 1-(2-hydroxy-1-phenylethyl)-3-(2-thiophen-3-ylethyl)urea (CID 110895806) is 1-(2-hydroxy-1-phenylethyl)-3-(2-thiophen-3-ylethyl)urea.
What is the SMILES notation for 1-(2-hydroxy-1-phenylethyl)-3-(2-thiophen-3-ylethyl)urea?
The canonical SMILES for 1-(2-hydroxy-1-phenylethyl)-3-(2-thiophen-3-ylethyl)urea is O=C(NCCc1ccsc1)NC(CO)c1ccccc1.
What is the InChIKey of 1-(2-hydroxy-1-phenylethyl)-3-(2-thiophen-3-ylethyl)urea?
The InChIKey is FMSLWMKTEQLAOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2S/c18-10-14(13-4-2-1-3-5-13)17-15(19)16-8-6-12-7-9-20-11-12/h1-5,7,9,11,14,18H,6,8,10H2,(H2,16,17,19).
What are the key properties of 1-(2-hydroxy-1-phenylethyl)-3-(2-thiophen-3-ylethyl)urea?
1-(2-hydroxy-1-phenylethyl)-3-(2-thiophen-3-ylethyl)urea has a molecular weight of 290.39 g/mol, XLogP of 2.32, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-hydroxy-1-phenylethyl)-3-(2-thiophen-3-ylethyl)urea is sourced from PubChem (CID 110895806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).