1-[4-[(1R)-2,3,4,9-tetrahydro-1H-carbazole-1-carbonyl]piperazin-1-yl]ethanone

C19H23N3O2 — CID 29258867

IUPAC1-[4-[(1R)-2,3,4,9-tetrahydro-1H-carbazole-1-carbonyl]piperazin-1-yl]ethanone
SMILESCC(=O)N1CCN(C(=O)[C@@H]2CCCc3c2[nH]c2ccccc32)CC1
InChIInChI=1S/C19H23N3O2/c1-13(23)21-9-11-22(12-10-21)19(24)16-7-4-6-15-14-5-2-3-8-17(14)20-18(15)16/h2-3,5,8,16,20H,4,6-7,9-12H2,1H3/t16-/m1/s1
InChIKeyPVJBPFHKVZBYBV-MRXNPFEDSA-N
MW325.41 g/mol
LogP2.28
Rot. Bonds1

About 1-[4-[(1R)-2,3,4,9-tetrahydro-1H-carbazole-1-carbonyl]piperazin-1-yl]ethanone

1-[4-[(1R)-2,3,4,9-tetrahydro-1H-carbazole-1-carbonyl]piperazin-1-yl]ethanone (PubChem CID 29258867) has the molecular formula C19H23N3O2 and a molecular weight of 325.41 g/mol. Its IUPAC name is 1-[4-[(1R)-2,3,4,9-tetrahydro-1H-carbazole-1-carbonyl]piperazin-1-yl]ethanone.

Molecular Properties

Compound Name1-[4-[(1R)-2,3,4,9-tetrahydro-1H-carbazole-1-carbonyl]piperazin-1-yl]ethanone
PubChem CID29258867
Molecular FormulaC19H23N3O2
Molecular Weight325.41 g/mol
Exact Mass325.18
IUPAC Name1-[4-[(1R)-2,3,4,9-tetrahydro-1H-carbazole-1-carbonyl]piperazin-1-yl]ethanone
SMILESCC(=O)N1CCN(C(=O)[C@@H]2CCCc3c2[nH]c2ccccc32)CC1
InChIInChI=1S/C19H23N3O2/c1-13(23)21-9-11-22(12-10-21)19(24)16-7-4-6-15-14-5-2-3-8-17(14)20-18(15)16/h2-3,5,8,16,20H,4,6-7,9-12H2,1H3/t16-/m1/s1
InChIKeyPVJBPFHKVZBYBV-MRXNPFEDSA-N
XLogP2.28
TPSA56.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-[4-[(1R)-2,3,4,9-tetrahydro-1H-carbazole-1-carbonyl]piperazin-1-yl]ethanone with MolForge

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Related Compounds

morpholin-4-yl(2,3,4,9-tetrahydro-1H-carbazol-1-yl)methanone
CID 131916432
(6-methyl-2,6-diazaspiro[3.3]heptan-2-yl)-(2,3,4,9-tetrahydro-1H-carbazol-1-yl)methanone
CID 154569334
[4-(1H-imidazol-2-yl)piperidin-1-yl]-(2,3,4,9-tetrahydro-1H-carbazol-1-yl)methanone
CID 70761206
(4-pyrimidin-2-ylpiperazin-1-yl)-(2,3,4,9-tetrahydro-1H-carbazol-1-yl)methanone;2,2,2-trifluoroacetic acid
CID 154885497
N-[[5-[(1R)-2,3,4,9-tetrahydro-1H-carbazole-1-carbonyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl]methyl]acetamide
CID 126426514
[(3S)-3-pyrimidin-4-ylpiperidin-1-yl]-[(1R)-2,3,4,9-tetrahydro-1H-carbazol-1-yl]methanone
CID 26278807
N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-2,3,4,9-tetrahydro-1H-carbazole-1-carboxamide
CID 131911526
1-[4-[1-(2-methylpropyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carbonyl]piperidin-1-yl]ethanone
CID 126459931
pyrrolidin-1-yl(2,3,4,9-tetrahydro-1H-carbazol-3-yl)methanone
CID 113203529
1-[(1R,12bS)-1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolizin-1-yl]ethanone;ethane
CID 90962597
1-cyclobutyl-2,3,4,9-tetrahydro-1H-carbazole
CID 91153684
N-[(3-methyl-2-methylsulfanylimidazol-4-yl)methyl]-2,3,4,9-tetrahydro-1H-carbazole-1-carboxamide
CID 131914265

Frequently Asked Questions

What is the IUPAC name of 1-[4-[(1R)-2,3,4,9-tetrahydro-1H-carbazole-1-carbonyl]piperazin-1-yl]ethanone?
The IUPAC name of 1-[4-[(1R)-2,3,4,9-tetrahydro-1H-carbazole-1-carbonyl]piperazin-1-yl]ethanone (CID 29258867) is 1-[4-[(1R)-2,3,4,9-tetrahydro-1H-carbazole-1-carbonyl]piperazin-1-yl]ethanone.
What is the SMILES notation for 1-[4-[(1R)-2,3,4,9-tetrahydro-1H-carbazole-1-carbonyl]piperazin-1-yl]ethanone?
The canonical SMILES for 1-[4-[(1R)-2,3,4,9-tetrahydro-1H-carbazole-1-carbonyl]piperazin-1-yl]ethanone is CC(=O)N1CCN(C(=O)[C@@H]2CCCc3c2[nH]c2ccccc32)CC1.
What is the InChIKey of 1-[4-[(1R)-2,3,4,9-tetrahydro-1H-carbazole-1-carbonyl]piperazin-1-yl]ethanone?
The InChIKey is PVJBPFHKVZBYBV-MRXNPFEDSA-N. The full InChI is InChI=1S/C19H23N3O2/c1-13(23)21-9-11-22(12-10-21)19(24)16-7-4-6-15-14-5-2-3-8-17(14)20-18(15)16/h2-3,5,8,16,20H,4,6-7,9-12H2,1H3/t16-/m1/s1.
What are the key properties of 1-[4-[(1R)-2,3,4,9-tetrahydro-1H-carbazole-1-carbonyl]piperazin-1-yl]ethanone?
1-[4-[(1R)-2,3,4,9-tetrahydro-1H-carbazole-1-carbonyl]piperazin-1-yl]ethanone has a molecular weight of 325.41 g/mol, XLogP of 2.28, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[(1R)-2,3,4,9-tetrahydro-1H-carbazole-1-carbonyl]piperazin-1-yl]ethanone is sourced from PubChem (CID 29258867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).