(2-methylnaphthalen-1-yl)-(5-methylthiophen-2-yl)methanol

C17H16OS — CID 79020949

IUPAC(2-methylnaphthalen-1-yl)-(5-methylthiophen-2-yl)methanol
SMILESCc1ccc(C(O)c2c(C)ccc3ccccc23)s1
InChIInChI=1S/C17H16OS/c1-11-7-9-13-5-3-4-6-14(13)16(11)17(18)15-10-8-12(2)19-15/h3-10,17-18H,1-2H3
InChIKeyUOTBZSAMSBFYIS-UHFFFAOYSA-N
MW268.38 g/mol
LogP4.60
Rot. Bonds2

About (2-methylnaphthalen-1-yl)-(5-methylthiophen-2-yl)methanol

(2-methylnaphthalen-1-yl)-(5-methylthiophen-2-yl)methanol (PubChem CID 79020949) has the molecular formula C17H16OS and a molecular weight of 268.38 g/mol. Its IUPAC name is (2-methylnaphthalen-1-yl)-(5-methylthiophen-2-yl)methanol.

Molecular Properties

Compound Name(2-methylnaphthalen-1-yl)-(5-methylthiophen-2-yl)methanol
PubChem CID79020949
Molecular FormulaC17H16OS
Molecular Weight268.38 g/mol
Exact Mass268.09
IUPAC Name(2-methylnaphthalen-1-yl)-(5-methylthiophen-2-yl)methanol
SMILESCc1ccc(C(O)c2c(C)ccc3ccccc23)s1
InChIInChI=1S/C17H16OS/c1-11-7-9-13-5-3-4-6-14(13)16(11)17(18)15-10-8-12(2)19-15/h3-10,17-18H,1-2H3
InChIKeyUOTBZSAMSBFYIS-UHFFFAOYSA-N
XLogP4.60
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.38
LogP ≤ 54.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(5-ethylthiophen-2-yl)-(2-methylnaphthalen-1-yl)methanol
CID 81432036
(2-methylnaphthalen-1-yl)-(1-methylpyrrol-2-yl)methanol
CID 91655781
(R)-furan-3-yl-(2-methylnaphthalen-1-yl)methanol
CID 97056042
(S)-(4-bromophenyl)-(2-methylnaphthalen-1-yl)methanol
CID 99714820
1-(2-methylnaphthalen-1-yl)propan-1-ol
CID 80502673
(1R)-2,2,2-trifluoro-1-(2-methylnaphthalen-1-yl)ethanol
CID 14810052
2,3-dimethyl-1-(2-methylnaphthalen-1-yl)butan-1-ol
CID 81432516
(R)-(4-amino-3-methylphenyl)-(2-methylnaphthalen-1-yl)methanol
CID 100804222
ethane;2-methyl-1-propan-2-ylnaphthalene
CID 144871891
(4-bromonaphthalen-1-yl)-(5-methylthiophen-2-yl)methanol
CID 79596868
2,2,3,3,3-pentafluoro-1-(2-methylnaphthalen-1-yl)propan-1-ol
CID 81431477
(5-bromo-2-fluorophenyl)-(2-methylnaphthalen-1-yl)methanol
CID 81431062

Frequently Asked Questions

What is the IUPAC name of (2-methylnaphthalen-1-yl)-(5-methylthiophen-2-yl)methanol?
The IUPAC name of (2-methylnaphthalen-1-yl)-(5-methylthiophen-2-yl)methanol (CID 79020949) is (2-methylnaphthalen-1-yl)-(5-methylthiophen-2-yl)methanol.
What is the SMILES notation for (2-methylnaphthalen-1-yl)-(5-methylthiophen-2-yl)methanol?
The canonical SMILES for (2-methylnaphthalen-1-yl)-(5-methylthiophen-2-yl)methanol is Cc1ccc(C(O)c2c(C)ccc3ccccc23)s1.
What is the InChIKey of (2-methylnaphthalen-1-yl)-(5-methylthiophen-2-yl)methanol?
The InChIKey is UOTBZSAMSBFYIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16OS/c1-11-7-9-13-5-3-4-6-14(13)16(11)17(18)15-10-8-12(2)19-15/h3-10,17-18H,1-2H3.
What are the key properties of (2-methylnaphthalen-1-yl)-(5-methylthiophen-2-yl)methanol?
(2-methylnaphthalen-1-yl)-(5-methylthiophen-2-yl)methanol has a molecular weight of 268.38 g/mol, XLogP of 4.60, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylnaphthalen-1-yl)-(5-methylthiophen-2-yl)methanol is sourced from PubChem (CID 79020949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).