2-cyclopentyl-N-[1-(1-methylindole-3-carbonyl)piperidin-4-yl]acetamide

C22H29N3O2 — CID 126792582

IUPAC2-cyclopentyl-N-[1-(1-methylindole-3-carbonyl)piperidin-4-yl]acetamide
SMILESCn1cc(C(=O)N2CCC(NC(=O)CC3CCCC3)CC2)c2ccccc21
InChIInChI=1S/C22H29N3O2/c1-24-15-19(18-8-4-5-9-20(18)24)22(27)25-12-10-17(11-13-25)23-21(26)14-16-6-2-3-7-16/h4-5,8-9,15-17H,2-3,6-7,10-14H2,1H3,(H,23,26)
InChIKeyGSOCPVAGQXOGBW-UHFFFAOYSA-N
MW367.49 g/mol
LogP3.48
Rot. Bonds4

About 2-cyclopentyl-N-[1-(1-methylindole-3-carbonyl)piperidin-4-yl]acetamide

2-cyclopentyl-N-[1-(1-methylindole-3-carbonyl)piperidin-4-yl]acetamide (PubChem CID 126792582) has the molecular formula C22H29N3O2 and a molecular weight of 367.49 g/mol. Its IUPAC name is 2-cyclopentyl-N-[1-(1-methylindole-3-carbonyl)piperidin-4-yl]acetamide.

Molecular Properties

Compound Name2-cyclopentyl-N-[1-(1-methylindole-3-carbonyl)piperidin-4-yl]acetamide
PubChem CID126792582
Molecular FormulaC22H29N3O2
Molecular Weight367.49 g/mol
Exact Mass367.23
IUPAC Name2-cyclopentyl-N-[1-(1-methylindole-3-carbonyl)piperidin-4-yl]acetamide
SMILESCn1cc(C(=O)N2CCC(NC(=O)CC3CCCC3)CC2)c2ccccc21
InChIInChI=1S/C22H29N3O2/c1-24-15-19(18-8-4-5-9-20(18)24)22(27)25-12-10-17(11-13-25)23-21(26)14-16-6-2-3-7-16/h4-5,8-9,15-17H,2-3,6-7,10-14H2,1H3,(H,23,26)
InChIKeyGSOCPVAGQXOGBW-UHFFFAOYSA-N
XLogP3.48
TPSA54.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.49
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

azetidin-1-yl-(1-methylindol-3-yl)methanone
CID 17458441
(1-methylindol-3-yl)-pyrrolidin-1-ylmethanone
CID 4207786
2-cyclohexyl-1-(1-methylindol-3-yl)ethanone
CID 43161950
2,5-dimethyl-N-[1-(1-methylindole-3-carbonyl)piperidin-4-yl]furan-3-carboxamide
CID 99816350
N-cyclopentyl-1-methylindole-3-carboxamide
CID 9209194
N-cyclopropyl-2-[4-(1-methylindole-3-carbonyl)piperazin-1-yl]propanamide
CID 46448196
[(3R)-3-(hydroxymethyl)pyrrolidin-1-yl]-(1-methylindol-3-yl)methanone
CID 166081487
[(4aS,8aR)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]-(1-methylindol-3-yl)methanone
CID 9225632
[2-(cyclooctylamino)-2-oxoethyl] 1-methylindole-3-carboxylate
CID 27571304
methyl 4-[[2-(1-methylindol-3-yl)acetyl]amino]piperidine-1-carboxylate
CID 86859520
4-(1-methylindole-3-carbonyl)piperazine-1-carbaldehyde
CID 110762463
1-[4-(1-methylindole-3-carbonyl)-1,4-diazepan-1-yl]ethanone
CID 110805536

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-N-[1-(1-methylindole-3-carbonyl)piperidin-4-yl]acetamide?
The IUPAC name of 2-cyclopentyl-N-[1-(1-methylindole-3-carbonyl)piperidin-4-yl]acetamide (CID 126792582) is 2-cyclopentyl-N-[1-(1-methylindole-3-carbonyl)piperidin-4-yl]acetamide.
What is the SMILES notation for 2-cyclopentyl-N-[1-(1-methylindole-3-carbonyl)piperidin-4-yl]acetamide?
The canonical SMILES for 2-cyclopentyl-N-[1-(1-methylindole-3-carbonyl)piperidin-4-yl]acetamide is Cn1cc(C(=O)N2CCC(NC(=O)CC3CCCC3)CC2)c2ccccc21.
What is the InChIKey of 2-cyclopentyl-N-[1-(1-methylindole-3-carbonyl)piperidin-4-yl]acetamide?
The InChIKey is GSOCPVAGQXOGBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H29N3O2/c1-24-15-19(18-8-4-5-9-20(18)24)22(27)25-12-10-17(11-13-25)23-21(26)14-16-6-2-3-7-16/h4-5,8-9,15-17H,2-3,6-7,10-14H2,1H3,(H,23,26).
What are the key properties of 2-cyclopentyl-N-[1-(1-methylindole-3-carbonyl)piperidin-4-yl]acetamide?
2-cyclopentyl-N-[1-(1-methylindole-3-carbonyl)piperidin-4-yl]acetamide has a molecular weight of 367.49 g/mol, XLogP of 3.48, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-N-[1-(1-methylindole-3-carbonyl)piperidin-4-yl]acetamide is sourced from PubChem (CID 126792582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).