N-cyclopentylphenothiazine-10-carboxamide

C18H18N2OS — CID 704267

IUPACN-cyclopentylphenothiazine-10-carboxamide
SMILESO=C(NC1CCCC1)N1c2ccccc2Sc2ccccc21
InChIInChI=1S/C18H18N2OS/c21-18(19-13-7-1-2-8-13)20-14-9-3-5-11-16(14)22-17-12-6-4-10-15(17)20/h3-6,9-13H,1-2,7-8H2,(H,19,21)
InChIKeyWVGVWICAQSPEPE-UHFFFAOYSA-N
MW310.42 g/mol
LogP4.94
Rot. Bonds1

About N-cyclopentylphenothiazine-10-carboxamide

N-cyclopentylphenothiazine-10-carboxamide (PubChem CID 704267) has the molecular formula C18H18N2OS and a molecular weight of 310.42 g/mol. Its IUPAC name is N-cyclopentylphenothiazine-10-carboxamide.

Molecular Properties

Compound NameN-cyclopentylphenothiazine-10-carboxamide
PubChem CID704267
Molecular FormulaC18H18N2OS
Molecular Weight310.42 g/mol
Exact Mass310.11
IUPAC NameN-cyclopentylphenothiazine-10-carboxamide
SMILESO=C(NC1CCCC1)N1c2ccccc2Sc2ccccc21
InChIInChI=1S/C18H18N2OS/c21-18(19-13-7-1-2-8-13)20-14-9-3-5-11-16(14)22-17-12-6-4-10-15(17)20/h3-6,9-13H,1-2,7-8H2,(H,19,21)
InChIKeyWVGVWICAQSPEPE-UHFFFAOYSA-N
XLogP4.94
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.42
LogP ≤ 54.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentylphenothiazine-10-carboxamide?
The IUPAC name of N-cyclopentylphenothiazine-10-carboxamide (CID 704267) is N-cyclopentylphenothiazine-10-carboxamide.
What is the SMILES notation for N-cyclopentylphenothiazine-10-carboxamide?
The canonical SMILES for N-cyclopentylphenothiazine-10-carboxamide is O=C(NC1CCCC1)N1c2ccccc2Sc2ccccc21.
What is the InChIKey of N-cyclopentylphenothiazine-10-carboxamide?
The InChIKey is WVGVWICAQSPEPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2OS/c21-18(19-13-7-1-2-8-13)20-14-9-3-5-11-16(14)22-17-12-6-4-10-15(17)20/h3-6,9-13H,1-2,7-8H2,(H,19,21).
What are the key properties of N-cyclopentylphenothiazine-10-carboxamide?
N-cyclopentylphenothiazine-10-carboxamide has a molecular weight of 310.42 g/mol, XLogP of 4.94, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentylphenothiazine-10-carboxamide is sourced from PubChem (CID 704267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).