3-[[2,3-dihydro-1H-inden-1-yl(methyl)carbamoyl]amino]-4-piperidin-1-ylbenzamide

C23H28N4O2 — CID 47818397

IUPAC3-[[2,3-dihydro-1H-inden-1-yl(methyl)carbamoyl]amino]-4-piperidin-1-ylbenzamide
SMILESCN(C(=O)Nc1cc(C(N)=O)ccc1N1CCCCC1)C1CCc2ccccc21
InChIInChI=1S/C23H28N4O2/c1-26(20-11-9-16-7-3-4-8-18(16)20)23(29)25-19-15-17(22(24)28)10-12-21(19)27-13-5-2-6-14-27/h3-4,7-8,10,12,15,20H,2,5-6,9,11,13-14H2,1H3,(H2,24,28)(H,25,29)
InChIKeyMFZGCEMONZEXFT-UHFFFAOYSA-N
MW392.50 g/mol
LogP3.93
Rot. Bonds4

About 3-[[2,3-dihydro-1H-inden-1-yl(methyl)carbamoyl]amino]-4-piperidin-1-ylbenzamide

3-[[2,3-dihydro-1H-inden-1-yl(methyl)carbamoyl]amino]-4-piperidin-1-ylbenzamide (PubChem CID 47818397) has the molecular formula C23H28N4O2 and a molecular weight of 392.50 g/mol. Its IUPAC name is 3-[[2,3-dihydro-1H-inden-1-yl(methyl)carbamoyl]amino]-4-piperidin-1-ylbenzamide.

Molecular Properties

Compound Name3-[[2,3-dihydro-1H-inden-1-yl(methyl)carbamoyl]amino]-4-piperidin-1-ylbenzamide
PubChem CID47818397
Molecular FormulaC23H28N4O2
Molecular Weight392.50 g/mol
Exact Mass392.22
IUPAC Name3-[[2,3-dihydro-1H-inden-1-yl(methyl)carbamoyl]amino]-4-piperidin-1-ylbenzamide
SMILESCN(C(=O)Nc1cc(C(N)=O)ccc1N1CCCCC1)C1CCc2ccccc21
InChIInChI=1S/C23H28N4O2/c1-26(20-11-9-16-7-3-4-8-18(16)20)23(29)25-19-15-17(22(24)28)10-12-21(19)27-13-5-2-6-14-27/h3-4,7-8,10,12,15,20H,2,5-6,9,11,13-14H2,1H3,(H2,24,28)(H,25,29)
InChIKeyMFZGCEMONZEXFT-UHFFFAOYSA-N
XLogP3.93
TPSA78.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.50
LogP ≤ 53.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-[[2,3-dihydro-1H-inden-1-yl(methyl)carbamoyl]amino]-4-piperidin-1-ylbenzamide 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 3-[[2,3-dihydro-1H-inden-1-yl(methyl)carbamoyl]amino]-4-piperidin-1-ylbenzamide?
The IUPAC name of 3-[[2,3-dihydro-1H-inden-1-yl(methyl)carbamoyl]amino]-4-piperidin-1-ylbenzamide (CID 47818397) is 3-[[2,3-dihydro-1H-inden-1-yl(methyl)carbamoyl]amino]-4-piperidin-1-ylbenzamide.
What is the SMILES notation for 3-[[2,3-dihydro-1H-inden-1-yl(methyl)carbamoyl]amino]-4-piperidin-1-ylbenzamide?
The canonical SMILES for 3-[[2,3-dihydro-1H-inden-1-yl(methyl)carbamoyl]amino]-4-piperidin-1-ylbenzamide is CN(C(=O)Nc1cc(C(N)=O)ccc1N1CCCCC1)C1CCc2ccccc21.
What is the InChIKey of 3-[[2,3-dihydro-1H-inden-1-yl(methyl)carbamoyl]amino]-4-piperidin-1-ylbenzamide?
The InChIKey is MFZGCEMONZEXFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N4O2/c1-26(20-11-9-16-7-3-4-8-18(16)20)23(29)25-19-15-17(22(24)28)10-12-21(19)27-13-5-2-6-14-27/h3-4,7-8,10,12,15,20H,2,5-6,9,11,13-14H2,1H3,(H2,24,28)(H,25,29).
What are the key properties of 3-[[2,3-dihydro-1H-inden-1-yl(methyl)carbamoyl]amino]-4-piperidin-1-ylbenzamide?
3-[[2,3-dihydro-1H-inden-1-yl(methyl)carbamoyl]amino]-4-piperidin-1-ylbenzamide has a molecular weight of 392.50 g/mol, XLogP of 3.93, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[2,3-dihydro-1H-inden-1-yl(methyl)carbamoyl]amino]-4-piperidin-1-ylbenzamide is sourced from PubChem (CID 47818397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).