2-phenyl-5-(3-phenylpropyl)thiophene

C19H18S — CID 15666584

IUPAC2-phenyl-5-(3-phenylpropyl)thiophene
SMILESc1ccc(CCCc2ccc(-c3ccccc3)s2)cc1
InChIInChI=1S/C19H18S/c1-3-8-16(9-4-1)10-7-13-18-14-15-19(20-18)17-11-5-2-6-12-17/h1-6,8-9,11-12,14-15H,7,10,13H2
InChIKeyRVQASEFDFUBKHS-UHFFFAOYSA-N
MW278.42 g/mol
LogP5.59
Rot. Bonds5

About 2-phenyl-5-(3-phenylpropyl)thiophene

2-phenyl-5-(3-phenylpropyl)thiophene (PubChem CID 15666584) has the molecular formula C19H18S and a molecular weight of 278.42 g/mol. Its IUPAC name is 2-phenyl-5-(3-phenylpropyl)thiophene.

Molecular Properties

Compound Name2-phenyl-5-(3-phenylpropyl)thiophene
PubChem CID15666584
Molecular FormulaC19H18S
Molecular Weight278.42 g/mol
Exact Mass278.11
IUPAC Name2-phenyl-5-(3-phenylpropyl)thiophene
SMILESc1ccc(CCCc2ccc(-c3ccccc3)s2)cc1
InChIInChI=1S/C19H18S/c1-3-8-16(9-4-1)10-7-13-18-14-15-19(20-18)17-11-5-2-6-12-17/h1-6,8-9,11-12,14-15H,7,10,13H2
InChIKeyRVQASEFDFUBKHS-UHFFFAOYSA-N
XLogP5.59
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500278.42
LogP ≤ 55.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-phenyl-N-[(5-phenylthiophen-2-yl)methyl]ethanamine
CID 43222657
2-iodo-5-(4-phenylbutyl)thiophene
CID 142912255
(5-phenylthiophen-2-yl)methanamine
CID 11993875
2-(3,3-dimethylbutyl)-5-(3-phenylpropyl)thiophene
CID 88505006
1-phenyl-3-(3-phenylpropyl)benzene
CID 153492299
1,4-bis(3-phenylpropyl)benzene
CID 59467322
CID 159131095
CID 159131095
7-[5-(3-phenylpropyl)thiophen-2-yl]heptanamide
CID 15667483
[3-(5-benzylthiophen-2-yl)phenyl]methanamine
CID 162008668
N-[(5-phenylthiophen-2-yl)methyl]aniline
CID 43756087
4-phenylbutylbenzene
CID 141301927
(2R)-1-(5-phenylthiophen-2-yl)propan-2-amine
CID 18656702

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-5-(3-phenylpropyl)thiophene?
The IUPAC name of 2-phenyl-5-(3-phenylpropyl)thiophene (CID 15666584) is 2-phenyl-5-(3-phenylpropyl)thiophene.
What is the SMILES notation for 2-phenyl-5-(3-phenylpropyl)thiophene?
The canonical SMILES for 2-phenyl-5-(3-phenylpropyl)thiophene is c1ccc(CCCc2ccc(-c3ccccc3)s2)cc1.
What is the InChIKey of 2-phenyl-5-(3-phenylpropyl)thiophene?
The InChIKey is RVQASEFDFUBKHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18S/c1-3-8-16(9-4-1)10-7-13-18-14-15-19(20-18)17-11-5-2-6-12-17/h1-6,8-9,11-12,14-15H,7,10,13H2.
What are the key properties of 2-phenyl-5-(3-phenylpropyl)thiophene?
2-phenyl-5-(3-phenylpropyl)thiophene has a molecular weight of 278.42 g/mol, XLogP of 5.59, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-5-(3-phenylpropyl)thiophene is sourced from PubChem (CID 15666584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).