2-[bis(2-methylphenyl)methyl]thiophene

C19H18S — CID 70541679

IUPAC2-[bis(2-methylphenyl)methyl]thiophene
SMILESCc1ccccc1C(c1cccs1)c1ccccc1C
InChIInChI=1S/C19H18S/c1-14-8-3-5-10-16(14)19(18-12-7-13-20-18)17-11-6-4-9-15(17)2/h3-13,19H,1-2H3
InChIKeyUPVNIAWHPWMCMB-UHFFFAOYSA-N
MW278.42 g/mol
LogP5.55
Rot. Bonds3

About 2-[bis(2-methylphenyl)methyl]thiophene

2-[bis(2-methylphenyl)methyl]thiophene (PubChem CID 70541679) has the molecular formula C19H18S and a molecular weight of 278.42 g/mol. Its IUPAC name is 2-[bis(2-methylphenyl)methyl]thiophene.

Molecular Properties

Compound Name2-[bis(2-methylphenyl)methyl]thiophene
PubChem CID70541679
Molecular FormulaC19H18S
Molecular Weight278.42 g/mol
Exact Mass278.11
IUPAC Name2-[bis(2-methylphenyl)methyl]thiophene
SMILESCc1ccccc1C(c1cccs1)c1ccccc1C
InChIInChI=1S/C19H18S/c1-14-8-3-5-10-16(14)19(18-12-7-13-20-18)17-11-6-4-9-15(17)2/h3-13,19H,1-2H3
InChIKeyUPVNIAWHPWMCMB-UHFFFAOYSA-N
XLogP5.55
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500278.42
LogP ≤ 55.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-[[4-(dimethylamino)-2-methylphenyl]-thiophen-2-ylmethyl]-N,N,3-trimethylaniline
CID 54224037
2-[(2-hydroxy-3,5-dimethylphenyl)-thiophen-2-ylmethyl]-4,6-dimethylphenol
CID 19351800
3-[[5-(diethylamino)-2-methylphenyl]-thiophen-2-ylmethyl]-N,N-diethyl-4-methylaniline
CID 69485775
(2-fluoro-3-methylphenyl)-thiophen-2-ylmethanol
CID 81477693
1-methyl-3-[(1-methylindol-3-yl)-thiophen-2-ylmethyl]indole
CID 5087383
2-propan-2-ylthiophene
CID 178128598
[2-[bis(2-methylphenyl)methyl]phenyl]methanetriamine;hydrochloride
CID 172809634
[(2-chloro-3-methylphenyl)-thiophen-2-ylmethyl]hydrazine
CID 105287597
(4-methyl-3-pyridinyl)-thiophen-2-ylmethanamine
CID 66274388
N-[(2-iodo-3-methylphenyl)-thiophen-2-ylmethyl]ethanamine
CID 114030052
2-[4-bromo-3-(2-methylphenyl)butyl]thiophene
CID 79418362
CID 174622324
CID 174622324

Frequently Asked Questions

What is the IUPAC name of 2-[bis(2-methylphenyl)methyl]thiophene?
The IUPAC name of 2-[bis(2-methylphenyl)methyl]thiophene (CID 70541679) is 2-[bis(2-methylphenyl)methyl]thiophene.
What is the SMILES notation for 2-[bis(2-methylphenyl)methyl]thiophene?
The canonical SMILES for 2-[bis(2-methylphenyl)methyl]thiophene is Cc1ccccc1C(c1cccs1)c1ccccc1C.
What is the InChIKey of 2-[bis(2-methylphenyl)methyl]thiophene?
The InChIKey is UPVNIAWHPWMCMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18S/c1-14-8-3-5-10-16(14)19(18-12-7-13-20-18)17-11-6-4-9-15(17)2/h3-13,19H,1-2H3.
What are the key properties of 2-[bis(2-methylphenyl)methyl]thiophene?
2-[bis(2-methylphenyl)methyl]thiophene has a molecular weight of 278.42 g/mol, XLogP of 5.55, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[bis(2-methylphenyl)methyl]thiophene is sourced from PubChem (CID 70541679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).