2-[[1-(2,3-dihydro-1H-inden-2-yl)piperidin-3-yl]methyl-(2-methoxyethyl)amino]acetamide

C20H31N3O2 — CID 72908178

IUPAC2-[[1-(2,3-dihydro-1H-inden-2-yl)piperidin-3-yl]methyl-(2-methoxyethyl)amino]acetamide
SMILESCOCCN(CC(N)=O)CC1CCCN(C2Cc3ccccc3C2)C1
InChIInChI=1S/C20H31N3O2/c1-25-10-9-22(15-20(21)24)13-16-5-4-8-23(14-16)19-11-17-6-2-3-7-18(17)12-19/h2-3,6-7,16,19H,4-5,8-15H2,1H3,(H2,21,24)
InChIKeyRUKRTVDHFBBCOS-UHFFFAOYSA-N
MW345.49 g/mol
LogP1.30
Rot. Bonds8

About 2-[[1-(2,3-dihydro-1H-inden-2-yl)piperidin-3-yl]methyl-(2-methoxyethyl)amino]acetamide

2-[[1-(2,3-dihydro-1H-inden-2-yl)piperidin-3-yl]methyl-(2-methoxyethyl)amino]acetamide (PubChem CID 72908178) has the molecular formula C20H31N3O2 and a molecular weight of 345.49 g/mol. Its IUPAC name is 2-[[1-(2,3-dihydro-1H-inden-2-yl)piperidin-3-yl]methyl-(2-methoxyethyl)amino]acetamide.

Molecular Properties

Compound Name2-[[1-(2,3-dihydro-1H-inden-2-yl)piperidin-3-yl]methyl-(2-methoxyethyl)amino]acetamide
PubChem CID72908178
Molecular FormulaC20H31N3O2
Molecular Weight345.49 g/mol
Exact Mass345.24
IUPAC Name2-[[1-(2,3-dihydro-1H-inden-2-yl)piperidin-3-yl]methyl-(2-methoxyethyl)amino]acetamide
SMILESCOCCN(CC(N)=O)CC1CCCN(C2Cc3ccccc3C2)C1
InChIInChI=1S/C20H31N3O2/c1-25-10-9-22(15-20(21)24)13-16-5-4-8-23(14-16)19-11-17-6-2-3-7-18(17)12-19/h2-3,6-7,16,19H,4-5,8-15H2,1H3,(H2,21,24)
InChIKeyRUKRTVDHFBBCOS-UHFFFAOYSA-N
XLogP1.30
TPSA58.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.49
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-[[1-(2,3-dihydro-1H-inden-2-yl)piperidin-3-yl]methyl-(2-methoxyethyl)amino]acetamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[[1-(2,3-dihydro-1H-inden-2-yl)piperidin-3-yl]methyl-(2-methoxyethyl)amino]acetamide?
The IUPAC name of 2-[[1-(2,3-dihydro-1H-inden-2-yl)piperidin-3-yl]methyl-(2-methoxyethyl)amino]acetamide (CID 72908178) is 2-[[1-(2,3-dihydro-1H-inden-2-yl)piperidin-3-yl]methyl-(2-methoxyethyl)amino]acetamide.
What is the SMILES notation for 2-[[1-(2,3-dihydro-1H-inden-2-yl)piperidin-3-yl]methyl-(2-methoxyethyl)amino]acetamide?
The canonical SMILES for 2-[[1-(2,3-dihydro-1H-inden-2-yl)piperidin-3-yl]methyl-(2-methoxyethyl)amino]acetamide is COCCN(CC(N)=O)CC1CCCN(C2Cc3ccccc3C2)C1.
What is the InChIKey of 2-[[1-(2,3-dihydro-1H-inden-2-yl)piperidin-3-yl]methyl-(2-methoxyethyl)amino]acetamide?
The InChIKey is RUKRTVDHFBBCOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H31N3O2/c1-25-10-9-22(15-20(21)24)13-16-5-4-8-23(14-16)19-11-17-6-2-3-7-18(17)12-19/h2-3,6-7,16,19H,4-5,8-15H2,1H3,(H2,21,24).
What are the key properties of 2-[[1-(2,3-dihydro-1H-inden-2-yl)piperidin-3-yl]methyl-(2-methoxyethyl)amino]acetamide?
2-[[1-(2,3-dihydro-1H-inden-2-yl)piperidin-3-yl]methyl-(2-methoxyethyl)amino]acetamide has a molecular weight of 345.49 g/mol, XLogP of 1.30, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[1-(2,3-dihydro-1H-inden-2-yl)piperidin-3-yl]methyl-(2-methoxyethyl)amino]acetamide is sourced from PubChem (CID 72908178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).