1-(4-ethylpiperazin-1-yl)-2-[(2-phenylcyclopropyl)amino]ethanone

C17H25N3O — CID 66978917

IUPAC1-(4-ethylpiperazin-1-yl)-2-[(2-phenylcyclopropyl)amino]ethanone
SMILESCCN1CCN(C(=O)CNC2CC2c2ccccc2)CC1
InChIInChI=1S/C17H25N3O/c1-2-19-8-10-20(11-9-19)17(21)13-18-16-12-15(16)14-6-4-3-5-7-14/h3-7,15-16,18H,2,8-13H2,1H3
InChIKeyNSALIPKFTPKQSE-UHFFFAOYSA-N
MW287.41 g/mol
LogP1.30
Rot. Bonds5

About 1-(4-ethylpiperazin-1-yl)-2-[(2-phenylcyclopropyl)amino]ethanone

1-(4-ethylpiperazin-1-yl)-2-[(2-phenylcyclopropyl)amino]ethanone (PubChem CID 66978917) has the molecular formula C17H25N3O and a molecular weight of 287.41 g/mol. Its IUPAC name is 1-(4-ethylpiperazin-1-yl)-2-[(2-phenylcyclopropyl)amino]ethanone.

Molecular Properties

Compound Name1-(4-ethylpiperazin-1-yl)-2-[(2-phenylcyclopropyl)amino]ethanone
PubChem CID66978917
Molecular FormulaC17H25N3O
Molecular Weight287.41 g/mol
Exact Mass287.20
IUPAC Name1-(4-ethylpiperazin-1-yl)-2-[(2-phenylcyclopropyl)amino]ethanone
SMILESCCN1CCN(C(=O)CNC2CC2c2ccccc2)CC1
InChIInChI=1S/C17H25N3O/c1-2-19-8-10-20(11-9-19)17(21)13-18-16-12-15(16)14-6-4-3-5-7-14/h3-7,15-16,18H,2,8-13H2,1H3
InChIKeyNSALIPKFTPKQSE-UHFFFAOYSA-N
XLogP1.30
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.41
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(4-ethylpiperazin-1-yl)-2-[(2-phenylcyclopropyl)amino]ethanone 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

2-[(2-phenylcyclopropyl)amino]-1-(4-phenylpiperazin-1-yl)ethanone
CID 66978926
methyl 4-[[4-[2-[(2-phenylcyclopropyl)amino]acetyl]piperazin-1-yl]methyl]benzoate
CID 153322681
1-(4-methylpiperazin-1-yl)-2-[[(1R,2S)-2-(4-phenoxyphenyl)cyclopropyl]amino]ethanone
CID 154002845
1-(4-methylpiperazin-1-yl)-2-[[(1S)-2-[4-(2-phenylethyl)phenyl]cyclopropyl]amino]ethanone;dihydrochloride
CID 71811172
1-[3-(dimethylamino)pyrrolidin-1-yl]-2-[(2-phenylcyclopropyl)amino]ethanone;dihydrochloride
CID 67378904
2-[[2-(4-cyclopropylphenyl)cyclopropyl]amino]-1-(4-methylpiperazin-1-yl)ethanone
CID 56960901
2-[[(1S)-2-(4-cyclopropylphenyl)cyclopropyl]amino]-1-(4-methylpiperazin-1-yl)ethanone
CID 58486500
N-hydroxy-4-[[4-[2-[(2-phenylcyclopropyl)amino]acetyl]piperazin-1-yl]methyl]benzamide;2,2,2-trifluoroacetic acid
CID 175752167
1-(4-methylpiperazin-1-yl)-2-[[2-[4-(2-phenylethoxy)phenyl]cyclopropyl]amino]ethanone
CID 66978908
2-[[2-[4-(4-fluorophenyl)phenyl]cyclopropyl]amino]-1-(4-methylpiperazin-1-yl)ethanone
CID 67370694
4-[4-[(1R,2S)-2-[[2-(4-methylpiperazin-1-yl)-2-oxoethyl]amino]cyclopropyl]phenyl]benzonitrile
CID 90654157
1-(4-methylpiperazin-1-yl)-2-[[2-[4-[2-(trifluoromethyl)phenyl]phenyl]cyclopropyl]amino]ethanone;dihydrochloride
CID 67378740

Frequently Asked Questions

What is the IUPAC name of 1-(4-ethylpiperazin-1-yl)-2-[(2-phenylcyclopropyl)amino]ethanone?
The IUPAC name of 1-(4-ethylpiperazin-1-yl)-2-[(2-phenylcyclopropyl)amino]ethanone (CID 66978917) is 1-(4-ethylpiperazin-1-yl)-2-[(2-phenylcyclopropyl)amino]ethanone.
What is the SMILES notation for 1-(4-ethylpiperazin-1-yl)-2-[(2-phenylcyclopropyl)amino]ethanone?
The canonical SMILES for 1-(4-ethylpiperazin-1-yl)-2-[(2-phenylcyclopropyl)amino]ethanone is CCN1CCN(C(=O)CNC2CC2c2ccccc2)CC1.
What is the InChIKey of 1-(4-ethylpiperazin-1-yl)-2-[(2-phenylcyclopropyl)amino]ethanone?
The InChIKey is NSALIPKFTPKQSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O/c1-2-19-8-10-20(11-9-19)17(21)13-18-16-12-15(16)14-6-4-3-5-7-14/h3-7,15-16,18H,2,8-13H2,1H3.
What are the key properties of 1-(4-ethylpiperazin-1-yl)-2-[(2-phenylcyclopropyl)amino]ethanone?
1-(4-ethylpiperazin-1-yl)-2-[(2-phenylcyclopropyl)amino]ethanone has a molecular weight of 287.41 g/mol, XLogP of 1.30, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethylpiperazin-1-yl)-2-[(2-phenylcyclopropyl)amino]ethanone is sourced from PubChem (CID 66978917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).