1-(phenothiazine-10-carbonyl)piperidine-4-carboxamide

C19H19N3O2S — CID 1389785

IUPAC1-(phenothiazine-10-carbonyl)piperidine-4-carboxamide
SMILESNC(=O)C1CCN(C(=O)N2c3ccccc3Sc3ccccc32)CC1
InChIInChI=1S/C19H19N3O2S/c20-18(23)13-9-11-21(12-10-13)19(24)22-14-5-1-3-7-16(14)25-17-8-4-2-6-15(17)22/h1-8,13H,9-12H2,(H2,20,23)
InChIKeyBOJKPZJBTFHKKG-UHFFFAOYSA-N
MW353.45 g/mol
LogP3.61
Rot. Bonds1

About 1-(phenothiazine-10-carbonyl)piperidine-4-carboxamide

1-(phenothiazine-10-carbonyl)piperidine-4-carboxamide (PubChem CID 1389785) has the molecular formula C19H19N3O2S and a molecular weight of 353.45 g/mol. Its IUPAC name is 1-(phenothiazine-10-carbonyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(phenothiazine-10-carbonyl)piperidine-4-carboxamide
PubChem CID1389785
Molecular FormulaC19H19N3O2S
Molecular Weight353.45 g/mol
Exact Mass353.12
IUPAC Name1-(phenothiazine-10-carbonyl)piperidine-4-carboxamide
SMILESNC(=O)C1CCN(C(=O)N2c3ccccc3Sc3ccccc32)CC1
InChIInChI=1S/C19H19N3O2S/c20-18(23)13-9-11-21(12-10-13)19(24)22-14-5-1-3-7-16(14)25-17-8-4-2-6-15(17)22/h1-8,13H,9-12H2,(H2,20,23)
InChIKeyBOJKPZJBTFHKKG-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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Frequently Asked Questions

What is the IUPAC name of 1-(phenothiazine-10-carbonyl)piperidine-4-carboxamide?
The IUPAC name of 1-(phenothiazine-10-carbonyl)piperidine-4-carboxamide (CID 1389785) is 1-(phenothiazine-10-carbonyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(phenothiazine-10-carbonyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(phenothiazine-10-carbonyl)piperidine-4-carboxamide is NC(=O)C1CCN(C(=O)N2c3ccccc3Sc3ccccc32)CC1.
What is the InChIKey of 1-(phenothiazine-10-carbonyl)piperidine-4-carboxamide?
The InChIKey is BOJKPZJBTFHKKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O2S/c20-18(23)13-9-11-21(12-10-13)19(24)22-14-5-1-3-7-16(14)25-17-8-4-2-6-15(17)22/h1-8,13H,9-12H2,(H2,20,23).
What are the key properties of 1-(phenothiazine-10-carbonyl)piperidine-4-carboxamide?
1-(phenothiazine-10-carbonyl)piperidine-4-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-4-carboxamide is sourced from PubChem (CID 1389785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).