4-N-cyclopropyl-1-N-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]benzene-1,4-dicarboxamide

C22H24N2O2 — CID 166235755

IUPAC4-N-cyclopropyl-1-N-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]benzene-1,4-dicarboxamide
SMILESO=C(NCCC1CCc2ccccc21)c1ccc(C(=O)NC2CC2)cc1
InChIInChI=1S/C22H24N2O2/c25-21(17-7-9-18(10-8-17)22(26)24-19-11-12-19)23-14-13-16-6-5-15-3-1-2-4-20(15)16/h1-4,7-10,16,19H,5-6,11-14H2,(H,23,25)(H,24,26)
InChIKeyQBKUIOGLESTNRS-UHFFFAOYSA-N
MW348.45 g/mol
LogP3.43
Rot. Bonds6

About 4-N-cyclopropyl-1-N-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]benzene-1,4-dicarboxamide

4-N-cyclopropyl-1-N-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]benzene-1,4-dicarboxamide (PubChem CID 166235755) has the molecular formula C22H24N2O2 and a molecular weight of 348.45 g/mol. Its IUPAC name is 4-N-cyclopropyl-1-N-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]benzene-1,4-dicarboxamide.

Molecular Properties

Compound Name4-N-cyclopropyl-1-N-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]benzene-1,4-dicarboxamide
PubChem CID166235755
Molecular FormulaC22H24N2O2
Molecular Weight348.45 g/mol
Exact Mass348.18
IUPAC Name4-N-cyclopropyl-1-N-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]benzene-1,4-dicarboxamide
SMILESO=C(NCCC1CCc2ccccc21)c1ccc(C(=O)NC2CC2)cc1
InChIInChI=1S/C22H24N2O2/c25-21(17-7-9-18(10-8-17)22(26)24-19-11-12-19)23-14-13-16-6-5-15-3-1-2-4-20(15)16/h1-4,7-10,16,19H,5-6,11-14H2,(H,23,25)(H,24,26)
InChIKeyQBKUIOGLESTNRS-UHFFFAOYSA-N
XLogP3.43
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.45
LogP ≤ 53.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 4-N-cyclopropyl-1-N-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]benzene-1,4-dicarboxamide with MolForge

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Related Compounds

N-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]-4-fluoro-3-propanoylbenzamide
CID 166367608
4-[[2-(2,3-dihydro-1H-inden-1-yl)ethylamino]methyl]benzoic acid
CID 122034931
N-[2-(1,2,3,4-tetrahydronaphthalen-1-yl)ethyl]cyclopropanecarboxamide
CID 22922689
2-[(1R)-2,3-dihydro-1H-inden-1-yl]-N-(4-hydroxycyclohexyl)acetamide
CID 98348274
N-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]-2-fluoro-5-propan-2-ylbenzamide
CID 166367622
4-N-cyclopropyl-1-N-[2-(2-fluorophenyl)ethyl]benzene-1,4-dicarboxamide
CID 109043298
2-[(1S)-2,3-dihydro-1H-inden-1-yl]-N-ethylethanamine
CID 124705366
3-[2-(2,3-dihydro-1H-inden-1-yl)ethylcarbamoyl-methylamino]-2-methylpropanoic acid
CID 122015918
N-[(1S,2S)-2-hydroxy-1,2,3,4-tetrahydronaphthalen-1-yl]benzamide
CID 102358584
N-cyclopropyl-4-(2,3-dihydro-1H-inden-1-ylamino)-3-nitrobenzamide
CID 51301435
4-benzyl-N-cyclopropylbenzamide
CID 45086871
N-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]-3-(2-oxopyrrolidin-1-yl)azetidine-1-carboxamide
CID 138053388

Frequently Asked Questions

What is the IUPAC name of 4-N-cyclopropyl-1-N-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]benzene-1,4-dicarboxamide?
The IUPAC name of 4-N-cyclopropyl-1-N-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]benzene-1,4-dicarboxamide (CID 166235755) is 4-N-cyclopropyl-1-N-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]benzene-1,4-dicarboxamide.
What is the SMILES notation for 4-N-cyclopropyl-1-N-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]benzene-1,4-dicarboxamide?
The canonical SMILES for 4-N-cyclopropyl-1-N-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]benzene-1,4-dicarboxamide is O=C(NCCC1CCc2ccccc21)c1ccc(C(=O)NC2CC2)cc1.
What is the InChIKey of 4-N-cyclopropyl-1-N-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]benzene-1,4-dicarboxamide?
The InChIKey is QBKUIOGLESTNRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N2O2/c25-21(17-7-9-18(10-8-17)22(26)24-19-11-12-19)23-14-13-16-6-5-15-3-1-2-4-20(15)16/h1-4,7-10,16,19H,5-6,11-14H2,(H,23,25)(H,24,26).
What are the key properties of 4-N-cyclopropyl-1-N-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]benzene-1,4-dicarboxamide?
4-N-cyclopropyl-1-N-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]benzene-1,4-dicarboxamide has a molecular weight of 348.45 g/mol, XLogP of 3.43, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-cyclopropyl-1-N-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]benzene-1,4-dicarboxamide is sourced from PubChem (CID 166235755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).