4-(2,3-dihydro-1H-inden-1-yl)-N-phenylpiperazine-1-carboxamide

C20H23N3O — CID 110399825

IUPAC4-(2,3-dihydro-1H-inden-1-yl)-N-phenylpiperazine-1-carboxamide
SMILESO=C(Nc1ccccc1)N1CCN(C2CCc3ccccc32)CC1
InChIInChI=1S/C20H23N3O/c24-20(21-17-7-2-1-3-8-17)23-14-12-22(13-15-23)19-11-10-16-6-4-5-9-18(16)19/h1-9,19H,10-15H2,(H,21,24)
InChIKeyGUFIFKJJAZNJJQ-UHFFFAOYSA-N
MW321.42 g/mol
LogP3.52
Rot. Bonds2

About 4-(2,3-dihydro-1H-inden-1-yl)-N-phenylpiperazine-1-carboxamide

4-(2,3-dihydro-1H-inden-1-yl)-N-phenylpiperazine-1-carboxamide (PubChem CID 110399825) has the molecular formula C20H23N3O and a molecular weight of 321.42 g/mol. Its IUPAC name is 4-(2,3-dihydro-1H-inden-1-yl)-N-phenylpiperazine-1-carboxamide.

Molecular Properties

Compound Name4-(2,3-dihydro-1H-inden-1-yl)-N-phenylpiperazine-1-carboxamide
PubChem CID110399825
Molecular FormulaC20H23N3O
Molecular Weight321.42 g/mol
Exact Mass321.18
IUPAC Name4-(2,3-dihydro-1H-inden-1-yl)-N-phenylpiperazine-1-carboxamide
SMILESO=C(Nc1ccccc1)N1CCN(C2CCc3ccccc32)CC1
InChIInChI=1S/C20H23N3O/c24-20(21-17-7-2-1-3-8-17)23-14-12-22(13-15-23)19-11-10-16-6-4-5-9-18(16)19/h1-9,19H,10-15H2,(H,21,24)
InChIKeyGUFIFKJJAZNJJQ-UHFFFAOYSA-N
XLogP3.52
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.42
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-(2,3-dihydro-1H-inden-1-yl)-N-phenylpiperazine-1-carboxamide with MolForge

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

Launch Full Analysis

Related Compounds

N-(4-chlorophenyl)-4-(2,3-dihydro-1H-inden-1-yl)piperazine-1-carboxamide
CID 110399826
3-[4-(2,3-dihydro-1H-inden-1-yl)piperazin-1-yl]-N-(4-phenylphenyl)propanamide
CID 15312802
[4-(2,3-dihydro-1H-inden-1-yl)piperazin-1-yl]-(3-fluorophenyl)methanone
CID 110399802
(3,4-difluorophenyl)-[4-(2,3-dihydro-1H-inden-1-yl)piperazin-1-yl]methanone
CID 110399834
4-(2,3-dihydro-1H-inden-1-yl)morpholine-2-carboxylic acid
CID 65067081
4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-N-phenylpiperidine-1-carboxamide
CID 2594222
(1S)-N,1-diphenyl-3,4-dihydro-1H-isoquinoline-2-carboxamide
CID 135391620
1-[(1S)-2,3-dihydro-1H-inden-1-yl]piperazine
CID 30634298
1-(phenylcarbamoyl)piperidine-4-carboxylate
CID 2113074
(3S)-1-N-phenyl-3-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]piperidine-1,3-dicarboxamide
CID 9081500
N-[2-[4-(2,3-dihydro-1H-inden-1-yl)piperazin-1-yl]ethyl]-4-phenylbenzamide
CID 10622315
1-[2-[4-(2,3-dihydro-1H-inden-1-yl)piperazine-1-carbonyl]pyrrolidin-1-yl]-2,2,2-trifluoroethanone
CID 110399846

Frequently Asked Questions

What is the IUPAC name of 4-(2,3-dihydro-1H-inden-1-yl)-N-phenylpiperazine-1-carboxamide?
The IUPAC name of 4-(2,3-dihydro-1H-inden-1-yl)-N-phenylpiperazine-1-carboxamide (CID 110399825) is 4-(2,3-dihydro-1H-inden-1-yl)-N-phenylpiperazine-1-carboxamide.
What is the SMILES notation for 4-(2,3-dihydro-1H-inden-1-yl)-N-phenylpiperazine-1-carboxamide?
The canonical SMILES for 4-(2,3-dihydro-1H-inden-1-yl)-N-phenylpiperazine-1-carboxamide is O=C(Nc1ccccc1)N1CCN(C2CCc3ccccc32)CC1.
What is the InChIKey of 4-(2,3-dihydro-1H-inden-1-yl)-N-phenylpiperazine-1-carboxamide?
The InChIKey is GUFIFKJJAZNJJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O/c24-20(21-17-7-2-1-3-8-17)23-14-12-22(13-15-23)19-11-10-16-6-4-5-9-18(16)19/h1-9,19H,10-15H2,(H,21,24).
What are the key properties of 4-(2,3-dihydro-1H-inden-1-yl)-N-phenylpiperazine-1-carboxamide?
4-(2,3-dihydro-1H-inden-1-yl)-N-phenylpiperazine-1-carboxamide has a molecular weight of 321.42 g/mol, XLogP of 3.52, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,3-dihydro-1H-inden-1-yl)-N-phenylpiperazine-1-carboxamide is sourced from PubChem (CID 110399825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).