N-propan-2-ylphenothiazine-10-carboxamide

C16H16N2OS — CID 704259

IUPACN-propan-2-ylphenothiazine-10-carboxamide
SMILESCC(C)NC(=O)N1c2ccccc2Sc2ccccc21
InChIInChI=1S/C16H16N2OS/c1-11(2)17-16(19)18-12-7-3-5-9-14(12)20-15-10-6-4-8-13(15)18/h3-11H,1-2H3,(H,17,19)
InChIKeyDIHZRSIYRBANNR-UHFFFAOYSA-N
MW284.38 g/mol
LogP4.41
Rot. Bonds1

About N-propan-2-ylphenothiazine-10-carboxamide

N-propan-2-ylphenothiazine-10-carboxamide (PubChem CID 704259) has the molecular formula C16H16N2OS and a molecular weight of 284.38 g/mol. Its IUPAC name is N-propan-2-ylphenothiazine-10-carboxamide.

Molecular Properties

Compound NameN-propan-2-ylphenothiazine-10-carboxamide
PubChem CID704259
Molecular FormulaC16H16N2OS
Molecular Weight284.38 g/mol
Exact Mass284.10
IUPAC NameN-propan-2-ylphenothiazine-10-carboxamide
SMILESCC(C)NC(=O)N1c2ccccc2Sc2ccccc21
InChIInChI=1S/C16H16N2OS/c1-11(2)17-16(19)18-12-7-3-5-9-14(12)20-15-10-6-4-8-13(15)18/h3-11H,1-2H3,(H,17,19)
InChIKeyDIHZRSIYRBANNR-UHFFFAOYSA-N
XLogP4.41
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.38
LogP ≤ 54.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-propan-2-ylphenothiazine-10-carboxamide?
The IUPAC name of N-propan-2-ylphenothiazine-10-carboxamide (CID 704259) is N-propan-2-ylphenothiazine-10-carboxamide.
What is the SMILES notation for N-propan-2-ylphenothiazine-10-carboxamide?
The canonical SMILES for N-propan-2-ylphenothiazine-10-carboxamide is CC(C)NC(=O)N1c2ccccc2Sc2ccccc21.
What is the InChIKey of N-propan-2-ylphenothiazine-10-carboxamide?
The InChIKey is DIHZRSIYRBANNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2OS/c1-11(2)17-16(19)18-12-7-3-5-9-14(12)20-15-10-6-4-8-13(15)18/h3-11H,1-2H3,(H,17,19).
What are the key properties of N-propan-2-ylphenothiazine-10-carboxamide?
N-propan-2-ylphenothiazine-10-carboxamide has a molecular weight of 284.38 g/mol, XLogP of 4.41, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-ylphenothiazine-10-carboxamide is sourced from PubChem (CID 704259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).