N-[3-(dimethylamino)propyl]-1-[2-(1H-indol-3-yl)acetyl]piperidine-4-carboxamide

C21H30N4O2 — CID 113003574

IUPACN-[3-(dimethylamino)propyl]-1-[2-(1H-indol-3-yl)acetyl]piperidine-4-carboxamide
SMILESCN(C)CCCNC(=O)C1CCN(C(=O)Cc2c[nH]c3ccccc23)CC1
InChIInChI=1S/C21H30N4O2/c1-24(2)11-5-10-22-21(27)16-8-12-25(13-9-16)20(26)14-17-15-23-19-7-4-3-6-18(17)19/h3-4,6-7,15-16,23H,5,8-14H2,1-2H3,(H,22,27)
InChIKeyVQGBNFLNZYFQCS-UHFFFAOYSA-N
MW370.50 g/mol
LogP2.02
Rot. Bonds7

About N-[3-(dimethylamino)propyl]-1-[2-(1H-indol-3-yl)acetyl]piperidine-4-carboxamide

N-[3-(dimethylamino)propyl]-1-[2-(1H-indol-3-yl)acetyl]piperidine-4-carboxamide (PubChem CID 113003574) has the molecular formula C21H30N4O2 and a molecular weight of 370.50 g/mol. Its IUPAC name is N-[3-(dimethylamino)propyl]-1-[2-(1H-indol-3-yl)acetyl]piperidine-4-carboxamide.

Molecular Properties

Compound NameN-[3-(dimethylamino)propyl]-1-[2-(1H-indol-3-yl)acetyl]piperidine-4-carboxamide
PubChem CID113003574
Molecular FormulaC21H30N4O2
Molecular Weight370.50 g/mol
Exact Mass370.24
IUPAC NameN-[3-(dimethylamino)propyl]-1-[2-(1H-indol-3-yl)acetyl]piperidine-4-carboxamide
SMILESCN(C)CCCNC(=O)C1CCN(C(=O)Cc2c[nH]c3ccccc23)CC1
InChIInChI=1S/C21H30N4O2/c1-24(2)11-5-10-22-21(27)16-8-12-25(13-9-16)20(26)14-17-15-23-19-7-4-3-6-18(17)19/h3-4,6-7,15-16,23H,5,8-14H2,1-2H3,(H,22,27)
InChIKeyVQGBNFLNZYFQCS-UHFFFAOYSA-N
XLogP2.02
TPSA68.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.50
LogP ≤ 52.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-[3-(dimethylamino)propyl]-1-[2-(1H-indol-3-yl)acetyl]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

N-[2-(dimethylamino)ethyl]-1-[2-(1H-indol-3-yl)acetyl]piperidine-4-carboxamide
CID 113003443
N-ethyl-1-[2-(1H-indol-3-yl)acetyl]piperidine-4-carboxamide
CID 51078734
N-[2-[4-[2-(1H-indol-3-yl)acetyl]piperazin-1-yl]-2-oxoethyl]cyclopropanecarboxamide
CID 55860352
N-[3-(dimethylamino)propyl]-1-(2-thiophen-2-ylacetyl)piperidine-4-carboxamide
CID 113003575
N-[2-(1H-indol-3-yl)ethyl]-1-(3-phenoxypropanoyl)piperidine-4-carboxamide
CID 60520759
2-(1H-indol-3-yl)-1-[4-(4-methylpiperazine-1-carbonyl)piperidin-1-yl]ethanone
CID 113003641
1-[3-(1H-indol-3-yl)propanoyl]-N-methylpiperidine-4-carboxamide
CID 30888669
N-(4-cyanophenyl)-1-[2-(1H-indol-3-yl)acetyl]piperidine-4-carboxamide
CID 113008816
N-(3-chlorophenyl)-1-[2-(1H-indol-3-yl)acetyl]piperidine-4-carboxamide
CID 113007151
1-[2-(1H-indol-3-yl)acetyl]-N-(3-methoxyphenyl)piperidine-4-carboxamide
CID 113007464
1-[4-(4-ethylpiperazine-1-carbonyl)piperidin-1-yl]-2-(1H-indol-3-yl)ethanone
CID 113003701
2-(1H-indol-3-yl)-1-(4-methylazepan-1-yl)ethanone
CID 62047169

Frequently Asked Questions

What is the IUPAC name of N-[3-(dimethylamino)propyl]-1-[2-(1H-indol-3-yl)acetyl]piperidine-4-carboxamide?
The IUPAC name of N-[3-(dimethylamino)propyl]-1-[2-(1H-indol-3-yl)acetyl]piperidine-4-carboxamide (CID 113003574) is N-[3-(dimethylamino)propyl]-1-[2-(1H-indol-3-yl)acetyl]piperidine-4-carboxamide.
What is the SMILES notation for N-[3-(dimethylamino)propyl]-1-[2-(1H-indol-3-yl)acetyl]piperidine-4-carboxamide?
The canonical SMILES for N-[3-(dimethylamino)propyl]-1-[2-(1H-indol-3-yl)acetyl]piperidine-4-carboxamide is CN(C)CCCNC(=O)C1CCN(C(=O)Cc2c[nH]c3ccccc23)CC1.
What is the InChIKey of N-[3-(dimethylamino)propyl]-1-[2-(1H-indol-3-yl)acetyl]piperidine-4-carboxamide?
The InChIKey is VQGBNFLNZYFQCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H30N4O2/c1-24(2)11-5-10-22-21(27)16-8-12-25(13-9-16)20(26)14-17-15-23-19-7-4-3-6-18(17)19/h3-4,6-7,15-16,23H,5,8-14H2,1-2H3,(H,22,27).
What are the key properties of N-[3-(dimethylamino)propyl]-1-[2-(1H-indol-3-yl)acetyl]piperidine-4-carboxamide?
N-[3-(dimethylamino)propyl]-1-[2-(1H-indol-3-yl)acetyl]piperidine-4-carboxamide has a molecular weight of 370.50 g/mol, XLogP of 2.02, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(dimethylamino)propyl]-1-[2-(1H-indol-3-yl)acetyl]piperidine-4-carboxamide is sourced from PubChem (CID 113003574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).