N-cyclohexylphenothiazine-10-carboxamide

C19H20N2OS — CID 705769

IUPACN-cyclohexylphenothiazine-10-carboxamide
SMILESO=C(NC1CCCCC1)N1c2ccccc2Sc2ccccc21
InChIInChI=1S/C19H20N2OS/c22-19(20-14-8-2-1-3-9-14)21-15-10-4-6-12-17(15)23-18-13-7-5-11-16(18)21/h4-7,10-14H,1-3,8-9H2,(H,20,22)
InChIKeyOKOVWMHSIFSGRG-UHFFFAOYSA-N
MW324.45 g/mol
LogP5.33
Rot. Bonds1

About N-cyclohexylphenothiazine-10-carboxamide

N-cyclohexylphenothiazine-10-carboxamide (PubChem CID 705769) has the molecular formula C19H20N2OS and a molecular weight of 324.45 g/mol. Its IUPAC name is N-cyclohexylphenothiazine-10-carboxamide.

Molecular Properties

Compound NameN-cyclohexylphenothiazine-10-carboxamide
PubChem CID705769
Molecular FormulaC19H20N2OS
Molecular Weight324.45 g/mol
Exact Mass324.13
IUPAC NameN-cyclohexylphenothiazine-10-carboxamide
SMILESO=C(NC1CCCCC1)N1c2ccccc2Sc2ccccc21
InChIInChI=1S/C19H20N2OS/c22-19(20-14-8-2-1-3-9-14)21-15-10-4-6-12-17(15)23-18-13-7-5-11-16(18)21/h4-7,10-14H,1-3,8-9H2,(H,20,22)
InChIKeyOKOVWMHSIFSGRG-UHFFFAOYSA-N
XLogP5.33
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500324.45
LogP ≤ 55.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexylphenothiazine-10-carboxamide?
The IUPAC name of N-cyclohexylphenothiazine-10-carboxamide (CID 705769) is N-cyclohexylphenothiazine-10-carboxamide.
What is the SMILES notation for N-cyclohexylphenothiazine-10-carboxamide?
The canonical SMILES for N-cyclohexylphenothiazine-10-carboxamide is O=C(NC1CCCCC1)N1c2ccccc2Sc2ccccc21.
What is the InChIKey of N-cyclohexylphenothiazine-10-carboxamide?
The InChIKey is OKOVWMHSIFSGRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2OS/c22-19(20-14-8-2-1-3-9-14)21-15-10-4-6-12-17(15)23-18-13-7-5-11-16(18)21/h4-7,10-14H,1-3,8-9H2,(H,20,22).
What are the key properties of N-cyclohexylphenothiazine-10-carboxamide?
N-cyclohexylphenothiazine-10-carboxamide has a molecular weight of 324.45 g/mol, XLogP of 5.33, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexylphenothiazine-10-carboxamide is sourced from PubChem (CID 705769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).