1-acetyl-N-(1H-indol-5-yl)piperidine-4-carboxamide

C16H19N3O2 — CID 110744988

IUPAC1-acetyl-N-(1H-indol-5-yl)piperidine-4-carboxamide
SMILESCC(=O)N1CCC(C(=O)Nc2ccc3[nH]ccc3c2)CC1
InChIInChI=1S/C16H19N3O2/c1-11(20)19-8-5-12(6-9-19)16(21)18-14-2-3-15-13(10-14)4-7-17-15/h2-4,7,10,12,17H,5-6,8-9H2,1H3,(H,18,21)
InChIKeyUVAHZKNUCVFHFL-UHFFFAOYSA-N
MW285.35 g/mol
LogP2.36
Rot. Bonds2

About 1-acetyl-N-(1H-indol-5-yl)piperidine-4-carboxamide

1-acetyl-N-(1H-indol-5-yl)piperidine-4-carboxamide (PubChem CID 110744988) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is 1-acetyl-N-(1H-indol-5-yl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-acetyl-N-(1H-indol-5-yl)piperidine-4-carboxamide
PubChem CID110744988
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC Name1-acetyl-N-(1H-indol-5-yl)piperidine-4-carboxamide
SMILESCC(=O)N1CCC(C(=O)Nc2ccc3[nH]ccc3c2)CC1
InChIInChI=1S/C16H19N3O2/c1-11(20)19-8-5-12(6-9-19)16(21)18-14-2-3-15-13(10-14)4-7-17-15/h2-4,7,10,12,17H,5-6,8-9H2,1H3,(H,18,21)
InChIKeyUVAHZKNUCVFHFL-UHFFFAOYSA-N
XLogP2.36
TPSA65.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 52.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1H-indol-5-yl)-1-(2,2,2-trifluoroacetyl)piperidine-4-carboxamide
CID 110730749
1-acetyl-N-(3-methyl-2-oxo-1H-quinolin-7-yl)piperidine-4-carboxamide
CID 110668263
N-(1H-indol-6-yl)-1-methylsulfonylpiperidine-4-carboxamide
CID 110730828
N-(1H-indol-5-yl)piperidine-3-carboxamide
CID 61248015
(3R)-N-(4-acetamidophenyl)-1-(1H-indole-5-carbonyl)piperidine-3-carboxamide
CID 41087933
N-(1H-indol-5-yl)-5-oxopyrrolidine-2-carboxamide
CID 110744978
2-(1H-indol-5-ylcarbamoyl)cyclobutane-1-carboxylic acid
CID 120974701
N-(1H-indol-6-yl)cycloheptanecarboxamide
CID 154864355
5-[(1-acetylpiperidine-4-carbonyl)amino]-2-hydroxybenzoic acid
CID 108804438
1-acetyl-N-(2,3-dihydro-1H-inden-5-yl)piperidine-4-carboxamide
CID 6468881
N-(1H-indol-5-yl)-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrole-3-carboxamide
CID 102892360
(3S)-N-(1H-indol-5-yl)-1-pyrimidin-2-ylpiperidine-3-carboxamide
CID 97263501

Frequently Asked Questions

What is the IUPAC name of 1-acetyl-N-(1H-indol-5-yl)piperidine-4-carboxamide?
The IUPAC name of 1-acetyl-N-(1H-indol-5-yl)piperidine-4-carboxamide (CID 110744988) is 1-acetyl-N-(1H-indol-5-yl)piperidine-4-carboxamide.
What is the SMILES notation for 1-acetyl-N-(1H-indol-5-yl)piperidine-4-carboxamide?
The canonical SMILES for 1-acetyl-N-(1H-indol-5-yl)piperidine-4-carboxamide is CC(=O)N1CCC(C(=O)Nc2ccc3[nH]ccc3c2)CC1.
What is the InChIKey of 1-acetyl-N-(1H-indol-5-yl)piperidine-4-carboxamide?
The InChIKey is UVAHZKNUCVFHFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2/c1-11(20)19-8-5-12(6-9-19)16(21)18-14-2-3-15-13(10-14)4-7-17-15/h2-4,7,10,12,17H,5-6,8-9H2,1H3,(H,18,21).
What are the key properties of 1-acetyl-N-(1H-indol-5-yl)piperidine-4-carboxamide?
1-acetyl-N-(1H-indol-5-yl)piperidine-4-carboxamide has a molecular weight of 285.35 g/mol, XLogP of 2.36, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-acetyl-N-(1H-indol-5-yl)piperidine-4-carboxamide is sourced from PubChem (CID 110744988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).