1-(7-chlorothieno[3,2-b]pyridin-2-yl)propan-2-ol

C10H10ClNOS — CID 162469989

IUPAC1-(7-chlorothieno[3,2-b]pyridin-2-yl)propan-2-ol
SMILESCC(O)Cc1cc2nccc(Cl)c2s1
InChIInChI=1S/C10H10ClNOS/c1-6(13)4-7-5-9-10(14-7)8(11)2-3-12-9/h2-3,5-6,13H,4H2,1H3
InChIKeySYTHTMFLAQXWAS-UHFFFAOYSA-N
MW227.72 g/mol
LogP2.87
Rot. Bonds2

About 1-(7-chlorothieno[3,2-b]pyridin-2-yl)propan-2-ol

1-(7-chlorothieno[3,2-b]pyridin-2-yl)propan-2-ol (PubChem CID 162469989) has the molecular formula C10H10ClNOS and a molecular weight of 227.72 g/mol. Its IUPAC name is 1-(7-chlorothieno[3,2-b]pyridin-2-yl)propan-2-ol.

Molecular Properties

Compound Name1-(7-chlorothieno[3,2-b]pyridin-2-yl)propan-2-ol
PubChem CID162469989
Molecular FormulaC10H10ClNOS
Molecular Weight227.72 g/mol
Exact Mass227.02
IUPAC Name1-(7-chlorothieno[3,2-b]pyridin-2-yl)propan-2-ol
SMILESCC(O)Cc1cc2nccc(Cl)c2s1
InChIInChI=1S/C10H10ClNOS/c1-6(13)4-7-5-9-10(14-7)8(11)2-3-12-9/h2-3,5-6,13H,4H2,1H3
InChIKeySYTHTMFLAQXWAS-UHFFFAOYSA-N
XLogP2.87
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.72
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(7-chlorothieno[3,2-b]pyridin-2-yl)propan-2-ol?
The IUPAC name of 1-(7-chlorothieno[3,2-b]pyridin-2-yl)propan-2-ol (CID 162469989) is 1-(7-chlorothieno[3,2-b]pyridin-2-yl)propan-2-ol.
What is the SMILES notation for 1-(7-chlorothieno[3,2-b]pyridin-2-yl)propan-2-ol?
The canonical SMILES for 1-(7-chlorothieno[3,2-b]pyridin-2-yl)propan-2-ol is CC(O)Cc1cc2nccc(Cl)c2s1.
What is the InChIKey of 1-(7-chlorothieno[3,2-b]pyridin-2-yl)propan-2-ol?
The InChIKey is SYTHTMFLAQXWAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10ClNOS/c1-6(13)4-7-5-9-10(14-7)8(11)2-3-12-9/h2-3,5-6,13H,4H2,1H3.
What are the key properties of 1-(7-chlorothieno[3,2-b]pyridin-2-yl)propan-2-ol?
1-(7-chlorothieno[3,2-b]pyridin-2-yl)propan-2-ol has a molecular weight of 227.72 g/mol, XLogP of 2.87, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(7-chlorothieno[3,2-b]pyridin-2-yl)propan-2-ol is sourced from PubChem (CID 162469989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).