naphthalen-2-yl(thieno[3,2-b]pyridin-6-yl)methanol

C18H13NOS — CID 81154098

IUPACnaphthalen-2-yl(thieno[3,2-b]pyridin-6-yl)methanol
SMILESOC(c1ccc2ccccc2c1)c1cnc2ccsc2c1
InChIInChI=1S/C18H13NOS/c20-18(15-10-17-16(19-11-15)7-8-21-17)14-6-5-12-3-1-2-4-13(12)9-14/h1-11,18,20H
InChIKeyDVVMJCDWFMAGMW-UHFFFAOYSA-N
MW291.38 g/mol
LogP4.53
Rot. Bonds2

About naphthalen-2-yl(thieno[3,2-b]pyridin-6-yl)methanol

naphthalen-2-yl(thieno[3,2-b]pyridin-6-yl)methanol (PubChem CID 81154098) has the molecular formula C18H13NOS and a molecular weight of 291.38 g/mol. Its IUPAC name is naphthalen-2-yl(thieno[3,2-b]pyridin-6-yl)methanol.

Molecular Properties

Compound Namenaphthalen-2-yl(thieno[3,2-b]pyridin-6-yl)methanol
PubChem CID81154098
Molecular FormulaC18H13NOS
Molecular Weight291.38 g/mol
Exact Mass291.07
IUPAC Namenaphthalen-2-yl(thieno[3,2-b]pyridin-6-yl)methanol
SMILESOC(c1ccc2ccccc2c1)c1cnc2ccsc2c1
InChIInChI=1S/C18H13NOS/c20-18(15-10-17-16(19-11-15)7-8-21-17)14-6-5-12-3-1-2-4-13(12)9-14/h1-11,18,20H
InChIKeyDVVMJCDWFMAGMW-UHFFFAOYSA-N
XLogP4.53
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.38
LogP ≤ 54.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3,5-difluorophenyl)-thieno[3,2-b]pyridin-6-ylmethanol
CID 81144116
thieno[3,2-b]pyridin-6-yl-[4-(trifluoromethyl)phenyl]methanol
CID 81154217
(4-propylphenyl)-thieno[3,2-b]pyridin-6-ylmethanol
CID 81143867
[3-(2-methylpropyl)phenyl]-thieno[3,2-b]pyridin-6-ylmethanol
CID 116543760
1-thieno[3,2-b]pyridin-6-ylethanol
CID 64830910
(7-fluoro-1-benzofuran-2-yl)-thieno[3,2-b]pyridin-6-ylmethanol
CID 114727100
naphthalen-2-yl(thieno[3,2-b]pyridin-6-yl)methanone
CID 81153173
2,2-dimethyl-1-thieno[3,2-b]pyridin-6-ylpropan-1-ol
CID 81143466
(2-amino-5-methyl-3-pyridinyl)-thieno[3,2-b]pyridin-6-ylmethanol
CID 81143004
(4-ethoxyphenyl)-quinolin-3-ylmethanol
CID 63893046
(4-methylphenyl)-quinolin-3-ylmethanol
CID 60924632
(4-chlorophenyl)-quinolin-3-ylmethanol
CID 20794845

Frequently Asked Questions

What is the IUPAC name of naphthalen-2-yl(thieno[3,2-b]pyridin-6-yl)methanol?
The IUPAC name of naphthalen-2-yl(thieno[3,2-b]pyridin-6-yl)methanol (CID 81154098) is naphthalen-2-yl(thieno[3,2-b]pyridin-6-yl)methanol.
What is the SMILES notation for naphthalen-2-yl(thieno[3,2-b]pyridin-6-yl)methanol?
The canonical SMILES for naphthalen-2-yl(thieno[3,2-b]pyridin-6-yl)methanol is OC(c1ccc2ccccc2c1)c1cnc2ccsc2c1.
What is the InChIKey of naphthalen-2-yl(thieno[3,2-b]pyridin-6-yl)methanol?
The InChIKey is DVVMJCDWFMAGMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13NOS/c20-18(15-10-17-16(19-11-15)7-8-21-17)14-6-5-12-3-1-2-4-13(12)9-14/h1-11,18,20H.
What are the key properties of naphthalen-2-yl(thieno[3,2-b]pyridin-6-yl)methanol?
naphthalen-2-yl(thieno[3,2-b]pyridin-6-yl)methanol has a molecular weight of 291.38 g/mol, XLogP of 4.53, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for naphthalen-2-yl(thieno[3,2-b]pyridin-6-yl)methanol is sourced from PubChem (CID 81154098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).