4-phenyl-N-(2-phenylcyclopropyl)piperazine-1-carboxamide

C20H23N3O — CID 3461621

IUPAC4-phenyl-N-(2-phenylcyclopropyl)piperazine-1-carboxamide
SMILESO=C(NC1CC1c1ccccc1)N1CCN(c2ccccc2)CC1
InChIInChI=1S/C20H23N3O/c24-20(21-19-15-18(19)16-7-3-1-4-8-16)23-13-11-22(12-14-23)17-9-5-2-6-10-17/h1-10,18-19H,11-15H2,(H,21,24)
InChIKeyAKEOTXLXKDOGRL-UHFFFAOYSA-N
MW321.42 g/mol
LogP3.07
Rot. Bonds3

About 4-phenyl-N-(2-phenylcyclopropyl)piperazine-1-carboxamide

4-phenyl-N-(2-phenylcyclopropyl)piperazine-1-carboxamide (PubChem CID 3461621) has the molecular formula C20H23N3O and a molecular weight of 321.42 g/mol. Its IUPAC name is 4-phenyl-N-(2-phenylcyclopropyl)piperazine-1-carboxamide.

Molecular Properties

Compound Name4-phenyl-N-(2-phenylcyclopropyl)piperazine-1-carboxamide
PubChem CID3461621
Molecular FormulaC20H23N3O
Molecular Weight321.42 g/mol
Exact Mass321.18
IUPAC Name4-phenyl-N-(2-phenylcyclopropyl)piperazine-1-carboxamide
SMILESO=C(NC1CC1c1ccccc1)N1CCN(c2ccccc2)CC1
InChIInChI=1S/C20H23N3O/c24-20(21-19-15-18(19)16-7-3-1-4-8-16)23-13-11-22(12-14-23)17-9-5-2-6-10-17/h1-10,18-19H,11-15H2,(H,21,24)
InChIKeyAKEOTXLXKDOGRL-UHFFFAOYSA-N
XLogP3.07
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.42
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-phenyl-N-(2-phenylcyclopropyl)piperazine-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-(2-phenylcyclopropyl)thiomorpholine-4-carboxamide
CID 23790831
4-methyl-N-(2-phenylcyclopropyl)piperidine-1-carboxamide
CID 60586425
2-[(2-phenylcyclopropyl)amino]-1-(4-phenylpiperazin-1-yl)ethanone
CID 66978926
4-(4-hydroxybenzoyl)-N-[(1R,2R)-2-phenylcyclopropyl]piperazine-1-carboxamide
CID 95196037
N'-methyl-4-phenyl-N-(2-phenylcyclopropyl)piperazine-1-carboximidamide;hydroiodide
CID 110962172
1-[(1S,2R)-2-phenylcyclopropyl]-3-(1-phenylpiperidin-4-yl)urea
CID 51050042
N-cyclohexyl-4-phenylpiperazine-1-carboxamide
CID 858165
N-[(1R,2S)-2-phenylcyclopropyl]-4-(sulfamoylmethyl)piperidine-1-carboxamide
CID 100728242
(2S)-2-cyano-N-[(1R,2S)-2-phenylcyclopropyl]morpholine-4-carboxamide
CID 129345423
N-[(1R,2R)-2-phenylcyclopropyl]acetamide
CID 6954168
1-[[(1R,2S)-2-phenylcyclopentyl]carbamoyl]piperidine-4-carboxylic acid
CID 122012024
(2R,4R)-4-hydroxy-1-[(2-phenylcyclopropyl)carbamoyl]pyrrolidine-2-carboxylic acid
CID 79000486

Frequently Asked Questions

What is the IUPAC name of 4-phenyl-N-(2-phenylcyclopropyl)piperazine-1-carboxamide?
The IUPAC name of 4-phenyl-N-(2-phenylcyclopropyl)piperazine-1-carboxamide (CID 3461621) is 4-phenyl-N-(2-phenylcyclopropyl)piperazine-1-carboxamide.
What is the SMILES notation for 4-phenyl-N-(2-phenylcyclopropyl)piperazine-1-carboxamide?
The canonical SMILES for 4-phenyl-N-(2-phenylcyclopropyl)piperazine-1-carboxamide is O=C(NC1CC1c1ccccc1)N1CCN(c2ccccc2)CC1.
What is the InChIKey of 4-phenyl-N-(2-phenylcyclopropyl)piperazine-1-carboxamide?
The InChIKey is AKEOTXLXKDOGRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O/c24-20(21-19-15-18(19)16-7-3-1-4-8-16)23-13-11-22(12-14-23)17-9-5-2-6-10-17/h1-10,18-19H,11-15H2,(H,21,24).
What are the key properties of 4-phenyl-N-(2-phenylcyclopropyl)piperazine-1-carboxamide?
4-phenyl-N-(2-phenylcyclopropyl)piperazine-1-carboxamide has a molecular weight of 321.42 g/mol, XLogP of 3.07, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenyl-N-(2-phenylcyclopropyl)piperazine-1-carboxamide is sourced from PubChem (CID 3461621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).