N-cyclobutylphenothiazine-10-carboxamide

C17H16N2OS — CID 46229054

IUPACN-cyclobutylphenothiazine-10-carboxamide
SMILESO=C(NC1CCC1)N1c2ccccc2Sc2ccccc21
InChIInChI=1S/C17H16N2OS/c20-17(18-12-6-5-7-12)19-13-8-1-3-10-15(13)21-16-11-4-2-9-14(16)19/h1-4,8-12H,5-7H2,(H,18,20)
InChIKeyKNYQZMOQFRAHIS-UHFFFAOYSA-N
MW296.39 g/mol
LogP4.55
Rot. Bonds1

About N-cyclobutylphenothiazine-10-carboxamide

N-cyclobutylphenothiazine-10-carboxamide (PubChem CID 46229054) has the molecular formula C17H16N2OS and a molecular weight of 296.39 g/mol. Its IUPAC name is N-cyclobutylphenothiazine-10-carboxamide.

Molecular Properties

Compound NameN-cyclobutylphenothiazine-10-carboxamide
PubChem CID46229054
Molecular FormulaC17H16N2OS
Molecular Weight296.39 g/mol
Exact Mass296.10
IUPAC NameN-cyclobutylphenothiazine-10-carboxamide
SMILESO=C(NC1CCC1)N1c2ccccc2Sc2ccccc21
InChIInChI=1S/C17H16N2OS/c20-17(18-12-6-5-7-12)19-13-8-1-3-10-15(13)21-16-11-4-2-9-14(16)19/h1-4,8-12H,5-7H2,(H,18,20)
InChIKeyKNYQZMOQFRAHIS-UHFFFAOYSA-N
XLogP4.55
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.39
LogP ≤ 54.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclobutylphenothiazine-10-carboxamide?
The IUPAC name of N-cyclobutylphenothiazine-10-carboxamide (CID 46229054) is N-cyclobutylphenothiazine-10-carboxamide.
What is the SMILES notation for N-cyclobutylphenothiazine-10-carboxamide?
The canonical SMILES for N-cyclobutylphenothiazine-10-carboxamide is O=C(NC1CCC1)N1c2ccccc2Sc2ccccc21.
What is the InChIKey of N-cyclobutylphenothiazine-10-carboxamide?
The InChIKey is KNYQZMOQFRAHIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2OS/c20-17(18-12-6-5-7-12)19-13-8-1-3-10-15(13)21-16-11-4-2-9-14(16)19/h1-4,8-12H,5-7H2,(H,18,20).
What are the key properties of N-cyclobutylphenothiazine-10-carboxamide?
N-cyclobutylphenothiazine-10-carboxamide has a molecular weight of 296.39 g/mol, XLogP of 4.55, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclobutylphenothiazine-10-carboxamide is sourced from PubChem (CID 46229054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).