N-(1-adamantyl)phenothiazine-10-carboxamide

C23H24N2OS — CID 3253193

IUPACN-(1-adamantyl)phenothiazine-10-carboxamide
SMILESO=C(NC12CC3CC(CC(C3)C1)C2)N1c2ccccc2Sc2ccccc21
InChIInChI=1S/C23H24N2OS/c26-22(24-23-12-15-9-16(13-23)11-17(10-15)14-23)25-18-5-1-3-7-20(18)27-21-8-4-2-6-19(21)25/h1-8,15-17H,9-14H2,(H,24,26)
InChIKeyYTNHIPMOCAHDRX-UHFFFAOYSA-N
MW376.52 g/mol
LogP5.97
Rot. Bonds1

About N-(1-adamantyl)phenothiazine-10-carboxamide

N-(1-adamantyl)phenothiazine-10-carboxamide (PubChem CID 3253193) has the molecular formula C23H24N2OS and a molecular weight of 376.52 g/mol. Its IUPAC name is N-(1-adamantyl)phenothiazine-10-carboxamide.

Molecular Properties

Compound NameN-(1-adamantyl)phenothiazine-10-carboxamide
PubChem CID3253193
Molecular FormulaC23H24N2OS
Molecular Weight376.52 g/mol
Exact Mass376.16
IUPAC NameN-(1-adamantyl)phenothiazine-10-carboxamide
SMILESO=C(NC12CC3CC(CC(C3)C1)C2)N1c2ccccc2Sc2ccccc21
InChIInChI=1S/C23H24N2OS/c26-22(24-23-12-15-9-16(13-23)11-17(10-15)14-23)25-18-5-1-3-7-20(18)27-21-8-4-2-6-19(21)25/h1-8,15-17H,9-14H2,(H,24,26)
InChIKeyYTNHIPMOCAHDRX-UHFFFAOYSA-N
XLogP5.97
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500376.52
LogP ≤ 55.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[4-[1-(10H-phenothiazin-2-yl)ethenyl]phenyl]urea
CID 141758658
N-phenyl-10H-phenothiazine-10-carboxamide
CID 777336
1-(1-Adamantyl)-3-(4-methylsulfanylphenyl)urea
CID 70696372
N-Tert-butylphenothiazine-10-carboxamide
CID 704261
N-(2-phenylethyl)-10H-phenothiazine-10-carboxamide
CID 704266
N-(2-methylphenyl)-10H-phenothiazine-10-carboxamide
CID 19916610
N-[(naphthalen-1-yl)methyl]-10H-phenothiazine-10-carboxamide
CID 23102336
1,1-dimethyl-3-[4-[1-(10H-phenothiazin-2-yl)ethenyl]phenyl]urea
CID 168271878
N-(2-methylpropyl)phenothiazine-10-carboxamide
CID 705752
N-(2,2,6,6-tetramethylpiperidin-4-yl)phenothiazine-10-carboxamide
CID 1278258
N-cyclohexyl-10H-phenothiazine-10-carboxamide
CID 705769
N-(4-Methylphenyl)phenothiazine-10-carboxamide
CID 934131

Frequently Asked Questions

What is the IUPAC name of N-(1-adamantyl)phenothiazine-10-carboxamide?
The IUPAC name of N-(1-adamantyl)phenothiazine-10-carboxamide (CID 3253193) is N-(1-adamantyl)phenothiazine-10-carboxamide.
What is the SMILES notation for N-(1-adamantyl)phenothiazine-10-carboxamide?
The canonical SMILES for N-(1-adamantyl)phenothiazine-10-carboxamide is O=C(NC12CC3CC(CC(C3)C1)C2)N1c2ccccc2Sc2ccccc21.
What is the InChIKey of N-(1-adamantyl)phenothiazine-10-carboxamide?
The InChIKey is YTNHIPMOCAHDRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2OS/c26-22(24-23-12-15-9-16(13-23)11-17(10-15)14-23)25-18-5-1-3-7-20(18)27-21-8-4-2-6-19(21)25/h1-8,15-17H,9-14H2,(H,24,26).
What are the key properties of N-(1-adamantyl)phenothiazine-10-carboxamide?
N-(1-adamantyl)phenothiazine-10-carboxamide has a molecular weight of 376.52 g/mol, XLogP of 5.97, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-adamantyl)phenothiazine-10-carboxamide is sourced from PubChem (CID 3253193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).