1-carbazol-9-yl-5-(3,5-dimethylpiperidin-1-yl)pentan-1-one

C24H30N2O — CID 122483254

IUPAC1-carbazol-9-yl-5-(3,5-dimethylpiperidin-1-yl)pentan-1-one
SMILESCC1CC(C)CN(CCCCC(=O)n2c3ccccc3c3ccccc32)C1
InChIInChI=1S/C24H30N2O/c1-18-15-19(2)17-25(16-18)14-8-7-13-24(27)26-22-11-5-3-9-20(22)21-10-4-6-12-23(21)26/h3-6,9-12,18-19H,7-8,13-17H2,1-2H3
InChIKeyRECOEEREFSFUIN-UHFFFAOYSA-N
MW362.52 g/mol
LogP5.58
Rot. Bonds5

About 1-carbazol-9-yl-5-(3,5-dimethylpiperidin-1-yl)pentan-1-one

1-carbazol-9-yl-5-(3,5-dimethylpiperidin-1-yl)pentan-1-one (PubChem CID 122483254) has the molecular formula C24H30N2O and a molecular weight of 362.52 g/mol. Its IUPAC name is 1-carbazol-9-yl-5-(3,5-dimethylpiperidin-1-yl)pentan-1-one.

Molecular Properties

Compound Name1-carbazol-9-yl-5-(3,5-dimethylpiperidin-1-yl)pentan-1-one
PubChem CID122483254
Molecular FormulaC24H30N2O
Molecular Weight362.52 g/mol
Exact Mass362.24
IUPAC Name1-carbazol-9-yl-5-(3,5-dimethylpiperidin-1-yl)pentan-1-one
SMILESCC1CC(C)CN(CCCCC(=O)n2c3ccccc3c3ccccc32)C1
InChIInChI=1S/C24H30N2O/c1-18-15-19(2)17-25(16-18)14-8-7-13-24(27)26-22-11-5-3-9-20(22)21-10-4-6-12-23(21)26/h3-6,9-12,18-19H,7-8,13-17H2,1-2H3
InChIKeyRECOEEREFSFUIN-UHFFFAOYSA-N
XLogP5.58
TPSA25.24 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500362.52
LogP ≤ 55.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-carbazol-9-yl-5-(4-methylpiperazin-1-yl)pentan-1-one;hydrochloride
CID 122483255
1-carbazol-9-yl-6-pyrrolidin-1-ylhexan-1-one;hydrochloride
CID 122483263
6-(4-acetylpiperazin-1-yl)-1-carbazol-9-ylhexan-1-one
CID 122483222
5-(4-acetylpiperazin-1-yl)-1-carbazol-9-ylpentan-1-one;hydrochloride
CID 122483225
5-(4-benzylpiperidin-1-yl)-1-carbazol-9-ylpentan-1-one;hydrochloride
CID 122483259
5-bromo-1-carbazol-9-ylpentan-1-one
CID 122483241
6-bromo-1-carbazol-9-ylhexan-1-one
CID 122483233
1-carbazol-9-yl-2-(4-methylpiperidin-1-yl)ethanone;hydrochloride
CID 44782279
N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-2-(3-methylindazol-1-yl)acetamide
CID 20886093
(3R,5S)-3,5-dimethyl-1-(6-naphthalen-1-yloxyhexyl)piperidine
CID 7377531
N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-1,5-dimethyl-4-oxopyrrolo[3,2-c]quinoline-2-carboxamide
CID 20865258
2-[3-[(3S,5R)-3,5-dimethylpiperidin-1-yl]propoxy]benzoic acid
CID 26582010

Frequently Asked Questions

What is the IUPAC name of 1-carbazol-9-yl-5-(3,5-dimethylpiperidin-1-yl)pentan-1-one?
The IUPAC name of 1-carbazol-9-yl-5-(3,5-dimethylpiperidin-1-yl)pentan-1-one (CID 122483254) is 1-carbazol-9-yl-5-(3,5-dimethylpiperidin-1-yl)pentan-1-one.
What is the SMILES notation for 1-carbazol-9-yl-5-(3,5-dimethylpiperidin-1-yl)pentan-1-one?
The canonical SMILES for 1-carbazol-9-yl-5-(3,5-dimethylpiperidin-1-yl)pentan-1-one is CC1CC(C)CN(CCCCC(=O)n2c3ccccc3c3ccccc32)C1.
What is the InChIKey of 1-carbazol-9-yl-5-(3,5-dimethylpiperidin-1-yl)pentan-1-one?
The InChIKey is RECOEEREFSFUIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30N2O/c1-18-15-19(2)17-25(16-18)14-8-7-13-24(27)26-22-11-5-3-9-20(22)21-10-4-6-12-23(21)26/h3-6,9-12,18-19H,7-8,13-17H2,1-2H3.
What are the key properties of 1-carbazol-9-yl-5-(3,5-dimethylpiperidin-1-yl)pentan-1-one?
1-carbazol-9-yl-5-(3,5-dimethylpiperidin-1-yl)pentan-1-one has a molecular weight of 362.52 g/mol, XLogP of 5.58, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-carbazol-9-yl-5-(3,5-dimethylpiperidin-1-yl)pentan-1-one is sourced from PubChem (CID 122483254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).