(5-chlorothiophen-2-yl)-pyridin-2-ylmethanol

C10H8ClNOS — CID 79021425

IUPAC(5-chlorothiophen-2-yl)-pyridin-2-ylmethanol
SMILESOC(c1ccccn1)c1ccc(Cl)s1
InChIInChI=1S/C10H8ClNOS/c11-9-5-4-8(14-9)10(13)7-3-1-2-6-12-7/h1-6,10,13H
InChIKeyJDNVHFOZBVHCEZ-UHFFFAOYSA-N
MW225.70 g/mol
LogP2.88
Rot. Bonds2

About (5-chlorothiophen-2-yl)-pyridin-2-ylmethanol

(5-chlorothiophen-2-yl)-pyridin-2-ylmethanol (PubChem CID 79021425) has the molecular formula C10H8ClNOS and a molecular weight of 225.70 g/mol. Its IUPAC name is (5-chlorothiophen-2-yl)-pyridin-2-ylmethanol.

Molecular Properties

Compound Name(5-chlorothiophen-2-yl)-pyridin-2-ylmethanol
PubChem CID79021425
Molecular FormulaC10H8ClNOS
Molecular Weight225.70 g/mol
Exact Mass225.00
IUPAC Name(5-chlorothiophen-2-yl)-pyridin-2-ylmethanol
SMILESOC(c1ccccn1)c1ccc(Cl)s1
InChIInChI=1S/C10H8ClNOS/c11-9-5-4-8(14-9)10(13)7-3-1-2-6-12-7/h1-6,10,13H
InChIKeyJDNVHFOZBVHCEZ-UHFFFAOYSA-N
XLogP2.88
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.70
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-1-(5-chlorothiophen-2-yl)-2-pyridin-2-ylpropan-1-ol
CID 80526991
dipyridin-2-ylmethanol;palladium(2+);dichloride
CID 173385206
(5-chlorothiophen-2-yl)-(2-methylpyrimidin-4-yl)methanol
CID 115527974
(5-chlorothiophen-2-yl)-thiophen-2-ylmethanol
CID 43234424
(R)-(5-chlorothiophen-2-yl)-thiophen-2-ylmethanol
CID 93029791
(2,3-dichlorophenyl)-pyridin-2-ylmethanol
CID 62791139
1-[(5-chlorothiophen-2-yl)-pyridin-2-ylmethyl]pyrrolidine-2-carboxylic acid
CID 3521832
2,2,2-trichloro-1-pyridin-2-ylethanol
CID 3066911
2-chloro-1-pyridin-2-ylethanol
CID 22145518
(1S)-2-chloro-1-(5-chlorothiophen-2-yl)ethanol
CID 83001660
(R)-(4-chloro-3-methylphenyl)-pyridin-2-ylmethanol
CID 97292925
(3-chloro-2-pyridinyl)-(5-chlorothiophen-2-yl)methanamine
CID 103443950

Frequently Asked Questions

What is the IUPAC name of (5-chlorothiophen-2-yl)-pyridin-2-ylmethanol?
The IUPAC name of (5-chlorothiophen-2-yl)-pyridin-2-ylmethanol (CID 79021425) is (5-chlorothiophen-2-yl)-pyridin-2-ylmethanol.
What is the SMILES notation for (5-chlorothiophen-2-yl)-pyridin-2-ylmethanol?
The canonical SMILES for (5-chlorothiophen-2-yl)-pyridin-2-ylmethanol is OC(c1ccccn1)c1ccc(Cl)s1.
What is the InChIKey of (5-chlorothiophen-2-yl)-pyridin-2-ylmethanol?
The InChIKey is JDNVHFOZBVHCEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8ClNOS/c11-9-5-4-8(14-9)10(13)7-3-1-2-6-12-7/h1-6,10,13H.
What are the key properties of (5-chlorothiophen-2-yl)-pyridin-2-ylmethanol?
(5-chlorothiophen-2-yl)-pyridin-2-ylmethanol has a molecular weight of 225.70 g/mol, XLogP of 2.88, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-chlorothiophen-2-yl)-pyridin-2-ylmethanol is sourced from PubChem (CID 79021425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).