(2-chloro-3-pyridinyl)-thiophen-2-ylmethanol

C10H8ClNOS — CID 23284530

IUPAC(2-chloro-3-pyridinyl)-thiophen-2-ylmethanol
SMILESOC(c1cccs1)c1cccnc1Cl
InChIInChI=1S/C10H8ClNOS/c11-10-7(3-1-5-12-10)9(13)8-4-2-6-14-8/h1-6,9,13H
InChIKeyREKFSUXKEHKGTC-UHFFFAOYSA-N
MW225.70 g/mol
LogP2.88
Rot. Bonds2

About (2-chloro-3-pyridinyl)-thiophen-2-ylmethanol

(2-chloro-3-pyridinyl)-thiophen-2-ylmethanol (PubChem CID 23284530) has the molecular formula C10H8ClNOS and a molecular weight of 225.70 g/mol. Its IUPAC name is (2-chloro-3-pyridinyl)-thiophen-2-ylmethanol.

Molecular Properties

Compound Name(2-chloro-3-pyridinyl)-thiophen-2-ylmethanol
PubChem CID23284530
Molecular FormulaC10H8ClNOS
Molecular Weight225.70 g/mol
Exact Mass225.00
IUPAC Name(2-chloro-3-pyridinyl)-thiophen-2-ylmethanol
SMILESOC(c1cccs1)c1cccnc1Cl
InChIInChI=1S/C10H8ClNOS/c11-10-7(3-1-5-12-10)9(13)8-4-2-6-14-8/h1-6,9,13H
InChIKeyREKFSUXKEHKGTC-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

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

(4-Chloro-2-fluorophenyl)-pyridin-3-yl-thiophen-2-ylmethanol
CID 56662427
(4-Chlorophenyl)-pyridin-3-yl-thiophen-3-ylmethanol
CID 56665868
(4-Chlorophenyl)-pyridin-3-yl-thiophen-2-ylmethanol
CID 56679338
(4-Chlorophenyl)-pyridin-3-yl-(1,3-thiazol-5-yl)methanol
CID 56682527
2-[3-[(2-Chloro-3-pyridinyl)-thiophen-2-ylmethoxy]prop-1-ynyl]aniline
CID 76332550
Pyridin-3-yl(thiophen-2-yl)methanol
CID 650499
2-Thiophenemethanol, 5-(3-pyridinyl)-
CID 11816351
3-Pyridinemethanol, 2-chloro-alpha-phenyl-
CID 3061980
1-(Pyridin-3-yl)-2-(thiophen-2-yl)propan-2-ol
CID 238325
2-[3-[(2-Chloro-3-pyridinyl)-thiophen-2-ylmethoxy]prop-1-ynyl]phenol
CID 76317984
(4-Chlorophenyl)-(5-methylthiophen-2-yl)-pyridin-3-ylmethanol
CID 56665590
(4-Chlorophenyl)-(3-methylthiophen-2-yl)-pyridin-3-ylmethanol
CID 56665737

Frequently Asked Questions

What is the IUPAC name of (2-chloro-3-pyridinyl)-thiophen-2-ylmethanol?
The IUPAC name of (2-chloro-3-pyridinyl)-thiophen-2-ylmethanol (CID 23284530) is (2-chloro-3-pyridinyl)-thiophen-2-ylmethanol.
What is the SMILES notation for (2-chloro-3-pyridinyl)-thiophen-2-ylmethanol?
The canonical SMILES for (2-chloro-3-pyridinyl)-thiophen-2-ylmethanol is OC(c1cccs1)c1cccnc1Cl.
What is the InChIKey of (2-chloro-3-pyridinyl)-thiophen-2-ylmethanol?
The InChIKey is REKFSUXKEHKGTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8ClNOS/c11-10-7(3-1-5-12-10)9(13)8-4-2-6-14-8/h1-6,9,13H.
What are the key properties of (2-chloro-3-pyridinyl)-thiophen-2-ylmethanol?
(2-chloro-3-pyridinyl)-thiophen-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 (2-chloro-3-pyridinyl)-thiophen-2-ylmethanol is sourced from PubChem (CID 23284530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).