1-(3-thiophen-2-ylcarbazol-9-yl)propan-2-ol

C19H17NOS — CID 139947774

IUPAC1-(3-thiophen-2-ylcarbazol-9-yl)propan-2-ol
SMILESCC(O)Cn1c2ccccc2c2cc(-c3cccs3)ccc21
InChIInChI=1S/C19H17NOS/c1-13(21)12-20-17-6-3-2-5-15(17)16-11-14(8-9-18(16)20)19-7-4-10-22-19/h2-11,13,21H,12H2,1H3
InChIKeyXQGRMRIEJONUSL-UHFFFAOYSA-N
MW307.42 g/mol
LogP4.90
Rot. Bonds3

About 1-(3-thiophen-2-ylcarbazol-9-yl)propan-2-ol

1-(3-thiophen-2-ylcarbazol-9-yl)propan-2-ol (PubChem CID 139947774) has the molecular formula C19H17NOS and a molecular weight of 307.42 g/mol. Its IUPAC name is 1-(3-thiophen-2-ylcarbazol-9-yl)propan-2-ol.

Molecular Properties

Compound Name1-(3-thiophen-2-ylcarbazol-9-yl)propan-2-ol
PubChem CID139947774
Molecular FormulaC19H17NOS
Molecular Weight307.42 g/mol
Exact Mass307.10
IUPAC Name1-(3-thiophen-2-ylcarbazol-9-yl)propan-2-ol
SMILESCC(O)Cn1c2ccccc2c2cc(-c3cccs3)ccc21
InChIInChI=1S/C19H17NOS/c1-13(21)12-20-17-6-3-2-5-15(17)16-11-14(8-9-18(16)20)19-7-4-10-22-19/h2-11,13,21H,12H2,1H3
InChIKeyXQGRMRIEJONUSL-UHFFFAOYSA-N
XLogP4.90
TPSA25.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.42
LogP ≤ 54.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(3-thiophen-2-ylcarbazol-9-yl)propan-2-ol?
The IUPAC name of 1-(3-thiophen-2-ylcarbazol-9-yl)propan-2-ol (CID 139947774) is 1-(3-thiophen-2-ylcarbazol-9-yl)propan-2-ol.
What is the SMILES notation for 1-(3-thiophen-2-ylcarbazol-9-yl)propan-2-ol?
The canonical SMILES for 1-(3-thiophen-2-ylcarbazol-9-yl)propan-2-ol is CC(O)Cn1c2ccccc2c2cc(-c3cccs3)ccc21.
What is the InChIKey of 1-(3-thiophen-2-ylcarbazol-9-yl)propan-2-ol?
The InChIKey is XQGRMRIEJONUSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17NOS/c1-13(21)12-20-17-6-3-2-5-15(17)16-11-14(8-9-18(16)20)19-7-4-10-22-19/h2-11,13,21H,12H2,1H3.
What are the key properties of 1-(3-thiophen-2-ylcarbazol-9-yl)propan-2-ol?
1-(3-thiophen-2-ylcarbazol-9-yl)propan-2-ol has a molecular weight of 307.42 g/mol, XLogP of 4.90, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-thiophen-2-ylcarbazol-9-yl)propan-2-ol is sourced from PubChem (CID 139947774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).