2-(1H-indol-3-yl)-N-(1-pentanoylpiperidin-4-yl)acetamide

C20H27N3O2 — CID 110819576

IUPAC2-(1H-indol-3-yl)-N-(1-pentanoylpiperidin-4-yl)acetamide
SMILESCCCCC(=O)N1CCC(NC(=O)Cc2c[nH]c3ccccc23)CC1
InChIInChI=1S/C20H27N3O2/c1-2-3-8-20(25)23-11-9-16(10-12-23)22-19(24)13-15-14-21-18-7-5-4-6-17(15)18/h4-7,14,16,21H,2-3,8-13H2,1H3,(H,22,24)
InChIKeyWZKITFSJOLFMPO-UHFFFAOYSA-N
MW341.45 g/mol
LogP3.01
Rot. Bonds6

About 2-(1H-indol-3-yl)-N-(1-pentanoylpiperidin-4-yl)acetamide

2-(1H-indol-3-yl)-N-(1-pentanoylpiperidin-4-yl)acetamide (PubChem CID 110819576) has the molecular formula C20H27N3O2 and a molecular weight of 341.45 g/mol. Its IUPAC name is 2-(1H-indol-3-yl)-N-(1-pentanoylpiperidin-4-yl)acetamide.

Molecular Properties

Compound Name2-(1H-indol-3-yl)-N-(1-pentanoylpiperidin-4-yl)acetamide
PubChem CID110819576
Molecular FormulaC20H27N3O2
Molecular Weight341.45 g/mol
Exact Mass341.21
IUPAC Name2-(1H-indol-3-yl)-N-(1-pentanoylpiperidin-4-yl)acetamide
SMILESCCCCC(=O)N1CCC(NC(=O)Cc2c[nH]c3ccccc23)CC1
InChIInChI=1S/C20H27N3O2/c1-2-3-8-20(25)23-11-9-16(10-12-23)22-19(24)13-15-14-21-18-7-5-4-6-17(15)18/h4-7,14,16,21H,2-3,8-13H2,1H3,(H,22,24)
InChIKeyWZKITFSJOLFMPO-UHFFFAOYSA-N
XLogP3.01
TPSA65.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.45
LogP ≤ 53.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]-2-(1H-indol-3-yl)acetamide
CID 110819918
N-[1-[2-(1H-indol-3-yl)acetyl]piperidin-4-yl]-3-methylbutanamide
CID 110820676
1-[4-(1H-indol-3-ylmethyl)piperazin-1-yl]pentan-1-one
CID 110397461
ethyl 4-[4-(1H-indol-3-yl)butanoylamino]piperidine-1-carboxylate
CID 51165109
1-(4-anilinopiperidin-1-yl)-4-(1H-indol-3-yl)butan-1-one
CID 47051691
3-(1H-indol-3-yl)-N-[1-(pyrrolidine-1-carbonyl)piperidin-4-yl]propanamide
CID 91765115
N-cyclopropyl-3-[[2-(1H-indol-3-yl)acetyl]amino]propanamide
CID 79382425
N-cyclopropyl-4-(1H-indol-3-yl)butanamide
CID 729220
ethyl 1-[4-(1H-indol-3-yl)butanoyl]piperidine-4-carboxylate
CID 35512444
2-(1H-indol-3-yl)-N-(3-methyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl)acetamide
CID 91910721
N-ethyl-1-[2-(1H-indol-3-yl)acetyl]piperidine-4-carboxamide
CID 51078734
4-(1H-indol-3-yl)-1-pyrrolidin-1-ylbutan-1-one
CID 18108564

Frequently Asked Questions

What is the IUPAC name of 2-(1H-indol-3-yl)-N-(1-pentanoylpiperidin-4-yl)acetamide?
The IUPAC name of 2-(1H-indol-3-yl)-N-(1-pentanoylpiperidin-4-yl)acetamide (CID 110819576) is 2-(1H-indol-3-yl)-N-(1-pentanoylpiperidin-4-yl)acetamide.
What is the SMILES notation for 2-(1H-indol-3-yl)-N-(1-pentanoylpiperidin-4-yl)acetamide?
The canonical SMILES for 2-(1H-indol-3-yl)-N-(1-pentanoylpiperidin-4-yl)acetamide is CCCCC(=O)N1CCC(NC(=O)Cc2c[nH]c3ccccc23)CC1.
What is the InChIKey of 2-(1H-indol-3-yl)-N-(1-pentanoylpiperidin-4-yl)acetamide?
The InChIKey is WZKITFSJOLFMPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27N3O2/c1-2-3-8-20(25)23-11-9-16(10-12-23)22-19(24)13-15-14-21-18-7-5-4-6-17(15)18/h4-7,14,16,21H,2-3,8-13H2,1H3,(H,22,24).
What are the key properties of 2-(1H-indol-3-yl)-N-(1-pentanoylpiperidin-4-yl)acetamide?
2-(1H-indol-3-yl)-N-(1-pentanoylpiperidin-4-yl)acetamide has a molecular weight of 341.45 g/mol, XLogP of 3.01, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-indol-3-yl)-N-(1-pentanoylpiperidin-4-yl)acetamide is sourced from PubChem (CID 110819576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).