3-(10H-phenothiazin-4-yl)propan-1-ol

C15H15NOS — CID 22419378

IUPAC3-(10H-phenothiazin-4-yl)propan-1-ol
SMILESOCCCc1cccc2c1Sc1ccccc1N2
InChIInChI=1S/C15H15NOS/c17-10-4-6-11-5-3-8-13-15(11)18-14-9-2-1-7-12(14)16-13/h1-3,5,7-9,16-17H,4,6,10H2
InChIKeyGNBPFPIHRAYNCI-UHFFFAOYSA-N
MW257.36 g/mol
LogP3.82
Rot. Bonds3

About 3-(10H-phenothiazin-4-yl)propan-1-ol

3-(10H-phenothiazin-4-yl)propan-1-ol (PubChem CID 22419378) has the molecular formula C15H15NOS and a molecular weight of 257.36 g/mol. Its IUPAC name is 3-(10H-phenothiazin-4-yl)propan-1-ol.

Molecular Properties

Compound Name3-(10H-phenothiazin-4-yl)propan-1-ol
PubChem CID22419378
Molecular FormulaC15H15NOS
Molecular Weight257.36 g/mol
Exact Mass257.09
IUPAC Name3-(10H-phenothiazin-4-yl)propan-1-ol
SMILESOCCCc1cccc2c1Sc1ccccc1N2
InChIInChI=1S/C15H15NOS/c17-10-4-6-11-5-3-8-13-15(11)18-14-9-2-1-7-12(14)16-13/h1-3,5,7-9,16-17H,4,6,10H2
InChIKeyGNBPFPIHRAYNCI-UHFFFAOYSA-N
XLogP3.82
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.36
LogP ≤ 53.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(10H-phenothiazin-4-yl)propan-1-ol?
The IUPAC name of 3-(10H-phenothiazin-4-yl)propan-1-ol (CID 22419378) is 3-(10H-phenothiazin-4-yl)propan-1-ol.
What is the SMILES notation for 3-(10H-phenothiazin-4-yl)propan-1-ol?
The canonical SMILES for 3-(10H-phenothiazin-4-yl)propan-1-ol is OCCCc1cccc2c1Sc1ccccc1N2.
What is the InChIKey of 3-(10H-phenothiazin-4-yl)propan-1-ol?
The InChIKey is GNBPFPIHRAYNCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NOS/c17-10-4-6-11-5-3-8-13-15(11)18-14-9-2-1-7-12(14)16-13/h1-3,5,7-9,16-17H,4,6,10H2.
What are the key properties of 3-(10H-phenothiazin-4-yl)propan-1-ol?
3-(10H-phenothiazin-4-yl)propan-1-ol has a molecular weight of 257.36 g/mol, XLogP of 3.82, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(10H-phenothiazin-4-yl)propan-1-ol is sourced from PubChem (CID 22419378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).