1-[3-(1H-indol-3-yl)propanoyl]piperidine-4-carboxamide

C17H21N3O2 — CID 17408046

IUPAC1-[3-(1H-indol-3-yl)propanoyl]piperidine-4-carboxamide
SMILESNC(=O)C1CCN(C(=O)CCc2c[nH]c3ccccc23)CC1
InChIInChI=1S/C17H21N3O2/c18-17(22)12-7-9-20(10-8-12)16(21)6-5-13-11-19-15-4-2-1-3-14(13)15/h1-4,11-12,19H,5-10H2,(H2,18,22)
InChIKeyCFYYEDLMNQGNGM-UHFFFAOYSA-N
MW299.37 g/mol
LogP1.82
Rot. Bonds4

About 1-[3-(1H-indol-3-yl)propanoyl]piperidine-4-carboxamide

1-[3-(1H-indol-3-yl)propanoyl]piperidine-4-carboxamide (PubChem CID 17408046) has the molecular formula C17H21N3O2 and a molecular weight of 299.37 g/mol. Its IUPAC name is 1-[3-(1H-indol-3-yl)propanoyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-[3-(1H-indol-3-yl)propanoyl]piperidine-4-carboxamide
PubChem CID17408046
Molecular FormulaC17H21N3O2
Molecular Weight299.37 g/mol
Exact Mass299.16
IUPAC Name1-[3-(1H-indol-3-yl)propanoyl]piperidine-4-carboxamide
SMILESNC(=O)C1CCN(C(=O)CCc2c[nH]c3ccccc23)CC1
InChIInChI=1S/C17H21N3O2/c18-17(22)12-7-9-20(10-8-12)16(21)6-5-13-11-19-15-4-2-1-3-14(13)15/h1-4,11-12,19H,5-10H2,(H2,18,22)
InChIKeyCFYYEDLMNQGNGM-UHFFFAOYSA-N
XLogP1.82
TPSA79.19 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.37
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 1-[3-(1H-indol-3-yl)propanoyl]piperidine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[3-(1H-indol-3-yl)propanoyl]-N-methylpiperidine-4-carboxamide
CID 30888669
1-[4-(4-hydroxybenzoyl)piperidin-1-yl]-3-(1H-indol-3-yl)propan-1-one
CID 51332191
ethyl 1-[4-(1H-indol-3-yl)butanoyl]piperidine-4-carboxylate
CID 35512444
1-(3-hydroxy-4-methylpiperidin-1-yl)-3-(1H-indol-3-yl)propan-1-one
CID 103900607
1-[4-[(1S,2S)-2-hydroxycyclopentyl]piperazin-1-yl]-3-(1H-indol-3-yl)propan-1-one
CID 97017418
4-(1H-indol-3-yl)-1-pyrrolidin-1-ylbutan-1-one
CID 18108564
3-(1H-indol-3-yl)-1-[3-(methoxymethyl)pyrrolidin-1-yl]propan-1-one
CID 64598046
1-[(3S)-3-aminopyrrolidin-1-yl]-4-(1H-indol-3-yl)butan-1-one
CID 94075010
1-(3,6-dihydro-2H-pyridin-1-yl)-3-(1H-indol-3-yl)propan-1-one
CID 115969994
3-(1H-indol-3-yl)-1-[(3S)-3-(trifluoromethyl)piperidin-1-yl]propan-1-one
CID 41037215
1-[(9aS)-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl]-3-(1H-indol-3-yl)propan-1-one
CID 94061393
3-(1H-indol-3-yl)-1-(4-pyrazin-2-ylpiperidin-1-yl)propan-1-one
CID 155983427

Frequently Asked Questions

What is the IUPAC name of 1-[3-(1H-indol-3-yl)propanoyl]piperidine-4-carboxamide?
The IUPAC name of 1-[3-(1H-indol-3-yl)propanoyl]piperidine-4-carboxamide (CID 17408046) is 1-[3-(1H-indol-3-yl)propanoyl]piperidine-4-carboxamide.
What is the SMILES notation for 1-[3-(1H-indol-3-yl)propanoyl]piperidine-4-carboxamide?
The canonical SMILES for 1-[3-(1H-indol-3-yl)propanoyl]piperidine-4-carboxamide is NC(=O)C1CCN(C(=O)CCc2c[nH]c3ccccc23)CC1.
What is the InChIKey of 1-[3-(1H-indol-3-yl)propanoyl]piperidine-4-carboxamide?
The InChIKey is CFYYEDLMNQGNGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O2/c18-17(22)12-7-9-20(10-8-12)16(21)6-5-13-11-19-15-4-2-1-3-14(13)15/h1-4,11-12,19H,5-10H2,(H2,18,22).
What are the key properties of 1-[3-(1H-indol-3-yl)propanoyl]piperidine-4-carboxamide?
1-[3-(1H-indol-3-yl)propanoyl]piperidine-4-carboxamide has a molecular weight of 299.37 g/mol, XLogP of 1.82, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(1H-indol-3-yl)propanoyl]piperidine-4-carboxamide is sourced from PubChem (CID 17408046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).