2-(2-methyl-1H-indol-3-yl)-N-(4-piperidin-1-yloxolan-3-yl)acetamide

C20H27N3O2 — CID 171359124

IUPAC2-(2-methyl-1H-indol-3-yl)-N-(4-piperidin-1-yloxolan-3-yl)acetamide
SMILESCc1[nH]c2ccccc2c1CC(=O)NC1COCC1N1CCCCC1
InChIInChI=1S/C20H27N3O2/c1-14-16(15-7-3-4-8-17(15)21-14)11-20(24)22-18-12-25-13-19(18)23-9-5-2-6-10-23/h3-4,7-8,18-19,21H,2,5-6,9-13H2,1H3,(H,22,24)
InChIKeyZIXSEUUPDNJNAJ-UHFFFAOYSA-N
MW341.45 g/mol
LogP2.39
Rot. Bonds4

About 2-(2-methyl-1H-indol-3-yl)-N-(4-piperidin-1-yloxolan-3-yl)acetamide

2-(2-methyl-1H-indol-3-yl)-N-(4-piperidin-1-yloxolan-3-yl)acetamide (PubChem CID 171359124) has the molecular formula C20H27N3O2 and a molecular weight of 341.45 g/mol. Its IUPAC name is 2-(2-methyl-1H-indol-3-yl)-N-(4-piperidin-1-yloxolan-3-yl)acetamide.

Molecular Properties

Compound Name2-(2-methyl-1H-indol-3-yl)-N-(4-piperidin-1-yloxolan-3-yl)acetamide
PubChem CID171359124
Molecular FormulaC20H27N3O2
Molecular Weight341.45 g/mol
Exact Mass341.21
IUPAC Name2-(2-methyl-1H-indol-3-yl)-N-(4-piperidin-1-yloxolan-3-yl)acetamide
SMILESCc1[nH]c2ccccc2c1CC(=O)NC1COCC1N1CCCCC1
InChIInChI=1S/C20H27N3O2/c1-14-16(15-7-3-4-8-17(15)21-14)11-20(24)22-18-12-25-13-19(18)23-9-5-2-6-10-23/h3-4,7-8,18-19,21H,2,5-6,9-13H2,1H3,(H,22,24)
InChIKeyZIXSEUUPDNJNAJ-UHFFFAOYSA-N
XLogP2.39
TPSA57.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.45
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}

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Related Compounds

2-(1,2-benzoxazol-3-yl)-N-[(3S,4S)-4-piperidin-1-yloxolan-3-yl]acetamide
CID 133260546
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(3R,4R)-4-piperidin-1-yloxolan-3-yl]acetamide
CID 118767384
1-(azepan-1-yl)-2-(2-methyl-1H-indol-3-yl)ethanone
CID 31849728
3-(2-oxo-3H-benzimidazol-1-yl)-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]propanamide
CID 77095907
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]acetamide
CID 122556067
N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]-2-thiophen-2-ylacetamide
CID 122560557
N-[(3R,4R)-1-[2-(dimethylamino)-2-oxoethyl]-3-hydroxypiperidin-4-yl]-2-(2-methyl-1H-indol-3-yl)acetamide
CID 118764876
3-phenoxy-N-[(3R,4R)-4-piperidin-1-yloxolan-3-yl]propanamide
CID 91788231
N-(3-methylcyclohexyl)-2-(2-methyl-1H-indol-3-yl)acetamide
CID 134005284
N-[(3S,4S)-4-piperidin-1-yloxolan-3-yl]-2-[3-(trifluoromethyl)phenyl]acetamide
CID 133266900
N-[2-(cyclopropylamino)-2-oxoethyl]-2-(2-methyl-1H-indol-3-yl)acetamide
CID 86925978
methyl 2-[2-(2-methyl-1H-indol-3-yl)acetyl]pyrazolidine-1-carboxylate
CID 4996754

Frequently Asked Questions

What is the IUPAC name of 2-(2-methyl-1H-indol-3-yl)-N-(4-piperidin-1-yloxolan-3-yl)acetamide?
The IUPAC name of 2-(2-methyl-1H-indol-3-yl)-N-(4-piperidin-1-yloxolan-3-yl)acetamide (CID 171359124) is 2-(2-methyl-1H-indol-3-yl)-N-(4-piperidin-1-yloxolan-3-yl)acetamide.
What is the SMILES notation for 2-(2-methyl-1H-indol-3-yl)-N-(4-piperidin-1-yloxolan-3-yl)acetamide?
The canonical SMILES for 2-(2-methyl-1H-indol-3-yl)-N-(4-piperidin-1-yloxolan-3-yl)acetamide is Cc1[nH]c2ccccc2c1CC(=O)NC1COCC1N1CCCCC1.
What is the InChIKey of 2-(2-methyl-1H-indol-3-yl)-N-(4-piperidin-1-yloxolan-3-yl)acetamide?
The InChIKey is ZIXSEUUPDNJNAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27N3O2/c1-14-16(15-7-3-4-8-17(15)21-14)11-20(24)22-18-12-25-13-19(18)23-9-5-2-6-10-23/h3-4,7-8,18-19,21H,2,5-6,9-13H2,1H3,(H,22,24).
What are the key properties of 2-(2-methyl-1H-indol-3-yl)-N-(4-piperidin-1-yloxolan-3-yl)acetamide?
2-(2-methyl-1H-indol-3-yl)-N-(4-piperidin-1-yloxolan-3-yl)acetamide has a molecular weight of 341.45 g/mol, XLogP of 2.39, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methyl-1H-indol-3-yl)-N-(4-piperidin-1-yloxolan-3-yl)acetamide is sourced from PubChem (CID 171359124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).