1-(phenothiazine-10-carbonyl)piperidine-3-carboxamide

C19H19N3O2S — CID 19056988

IUPAC1-(phenothiazine-10-carbonyl)piperidine-3-carboxamide
SMILESNC(=O)C1CCCN(C(=O)N2c3ccccc3Sc3ccccc32)C1
InChIInChI=1S/C19H19N3O2S/c20-18(23)13-6-5-11-21(12-13)19(24)22-14-7-1-3-9-16(14)25-17-10-4-2-8-15(17)22/h1-4,7-10,13H,5-6,11-12H2,(H2,20,23)
InChIKeyXFVITXCDKIWNMZ-UHFFFAOYSA-N
MW353.45 g/mol
LogP3.61
Rot. Bonds1

About 1-(phenothiazine-10-carbonyl)piperidine-3-carboxamide

1-(phenothiazine-10-carbonyl)piperidine-3-carboxamide (PubChem CID 19056988) has the molecular formula C19H19N3O2S and a molecular weight of 353.45 g/mol. Its IUPAC name is 1-(phenothiazine-10-carbonyl)piperidine-3-carboxamide.

Molecular Properties

Compound Name1-(phenothiazine-10-carbonyl)piperidine-3-carboxamide
PubChem CID19056988
Molecular FormulaC19H19N3O2S
Molecular Weight353.45 g/mol
Exact Mass353.12
IUPAC Name1-(phenothiazine-10-carbonyl)piperidine-3-carboxamide
SMILESNC(=O)C1CCCN(C(=O)N2c3ccccc3Sc3ccccc32)C1
InChIInChI=1S/C19H19N3O2S/c20-18(23)13-6-5-11-21(12-13)19(24)22-14-7-1-3-9-16(14)25-17-10-4-2-8-15(17)22/h1-4,7-10,13H,5-6,11-12H2,(H2,20,23)
InChIKeyXFVITXCDKIWNMZ-UHFFFAOYSA-N
XLogP3.61
TPSA66.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.45
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(4-methylpiperidin-1-yl)-phenothiazin-10-ylmethanone
CID 714968
(3S)-1-N-(2-chlorophenyl)piperidine-1,3-dicarboxamide
CID 7366630
phenothiazin-10-yl-(4-phenylpiperazin-1-yl)methanone
CID 1313122
1-(2-bromobenzoyl)piperidine-3-carboxamide
CID 24692766
2-[(1S,9aR)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]-1-phenothiazin-10-ylethanone
CID 54587102
(3S)-1-[(Z)-3-(2-chlorophenyl)but-2-enoyl]piperidine-3-carboxamide
CID 95298160
1-[2-[(1S)-1-aminoethyl]phenyl]piperidine-3-carboxamide
CID 78935941
(3S)-1-[2-(2-ethylphenyl)acetyl]piperidine-3-carboxamide
CID 172675194
(3S)-1-[(2R)-2-thiophen-2-ylpropanoyl]piperidine-3-carboxamide
CID 172908504
methyl 1-(phenothiazine-10-carbonyl)piperidine-2-carboxylate
CID 23521306
1-(hydrazinecarbonyl)piperidine-3-carboxamide
CID 43164061
1-[(E)-C-aminocarbonohydrazonoyl]piperidine-3-carboxamide
CID 126972262

Frequently Asked Questions

What is the IUPAC name of 1-(phenothiazine-10-carbonyl)piperidine-3-carboxamide?
The IUPAC name of 1-(phenothiazine-10-carbonyl)piperidine-3-carboxamide (CID 19056988) is 1-(phenothiazine-10-carbonyl)piperidine-3-carboxamide.
What is the SMILES notation for 1-(phenothiazine-10-carbonyl)piperidine-3-carboxamide?
The canonical SMILES for 1-(phenothiazine-10-carbonyl)piperidine-3-carboxamide is NC(=O)C1CCCN(C(=O)N2c3ccccc3Sc3ccccc32)C1.
What is the InChIKey of 1-(phenothiazine-10-carbonyl)piperidine-3-carboxamide?
The InChIKey is XFVITXCDKIWNMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O2S/c20-18(23)13-6-5-11-21(12-13)19(24)22-14-7-1-3-9-16(14)25-17-10-4-2-8-15(17)22/h1-4,7-10,13H,5-6,11-12H2,(H2,20,23).
What are the key properties of 1-(phenothiazine-10-carbonyl)piperidine-3-carboxamide?
1-(phenothiazine-10-carbonyl)piperidine-3-carboxamide has a molecular weight of 353.45 g/mol, XLogP of 3.61, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(phenothiazine-10-carbonyl)piperidine-3-carboxamide is sourced from PubChem (CID 19056988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).