1-phenyl-3-[3-(4-phenylpiperazin-1-yl)propyl]imidazolidin-2-one;hydrochloride

C22H29ClN4O — CID 19102619

IUPAC1-phenyl-3-[3-(4-phenylpiperazin-1-yl)propyl]imidazolidin-2-one;hydrochloride
SMILESCl.O=C1N(CCCN2CCN(c3ccccc3)CC2)CCN1c1ccccc1
InChIInChI=1S/C22H28N4O.ClH/c27-22-25(18-19-26(22)21-10-5-2-6-11-21)13-7-12-23-14-16-24(17-15-23)20-8-3-1-4-9-20;/h1-6,8-11H,7,12-19H2;1H
InChIKeyORWIQXMGTQPHQA-UHFFFAOYSA-N
MW400.95 g/mol
LogP3.56
Rot. Bonds6

About 1-phenyl-3-[3-(4-phenylpiperazin-1-yl)propyl]imidazolidin-2-one;hydrochloride

1-phenyl-3-[3-(4-phenylpiperazin-1-yl)propyl]imidazolidin-2-one;hydrochloride (PubChem CID 19102619) has the molecular formula C22H29ClN4O and a molecular weight of 400.95 g/mol. Its IUPAC name is 1-phenyl-3-[3-(4-phenylpiperazin-1-yl)propyl]imidazolidin-2-one;hydrochloride.

Molecular Properties

Compound Name1-phenyl-3-[3-(4-phenylpiperazin-1-yl)propyl]imidazolidin-2-one;hydrochloride
PubChem CID19102619
Molecular FormulaC22H29ClN4O
Molecular Weight400.95 g/mol
Exact Mass400.20
IUPAC Name1-phenyl-3-[3-(4-phenylpiperazin-1-yl)propyl]imidazolidin-2-one;hydrochloride
SMILESCl.O=C1N(CCCN2CCN(c3ccccc3)CC2)CCN1c1ccccc1
InChIInChI=1S/C22H28N4O.ClH/c27-22-25(18-19-26(22)21-10-5-2-6-11-21)13-7-12-23-14-16-24(17-15-23)20-8-3-1-4-9-20;/h1-6,8-11H,7,12-19H2;1H
InChIKeyORWIQXMGTQPHQA-UHFFFAOYSA-N
XLogP3.56
TPSA30.03 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500400.95
LogP ≤ 53.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-chlorophenyl)-3-[3-[4-(3-methylphenyl)piperazin-1-yl]propyl]imidazolidin-2-one
CID 19102614
2-[4-(4-phenylpiperazin-1-yl)butyl]-3H-isoindol-1-one;dihydrochloride
CID 42626219
3-(2-oxo-3-phenylimidazolidin-1-yl)propanal
CID 84786113
1-(3-phenoxypropyl)-4-phenylpiperazine;hydrochloride
CID 53329616
2-[3-(4-phenylpiperazin-1-yl)propyl]-5,6,7,7a-tetrahydropyrrolo[1,2-c]imidazole-1,3-dione
CID 10807257
1-[2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)ethyl]-3-phenylimidazolidin-2-one
CID 154244713
1-(2-methylsulfonylethyl)-4-phenylpiperazine
CID 70946596
6,6-dimethyl-3-[3-(4-phenylpiperazin-1-yl)propyl]-1,3-diazinane-2,4-dione;hydrochloride
CID 3053458
(1S,2R,6S,7R)-4-[4-(4-phenylpiperazin-1-yl)butyl]-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione
CID 25266539
1-[2-(azetidin-3-yl)ethyl]-3-phenylimidazolidin-2-one
CID 70500307
1-methyl-3-[3-(4-phenylpiperazin-1-yl)propyl]quinazoline-2,4-dione
CID 102058215
3-(4-phenylpiperazin-1-yl)propyl sulfite
CID 174503214

Frequently Asked Questions

What is the IUPAC name of 1-phenyl-3-[3-(4-phenylpiperazin-1-yl)propyl]imidazolidin-2-one;hydrochloride?
The IUPAC name of 1-phenyl-3-[3-(4-phenylpiperazin-1-yl)propyl]imidazolidin-2-one;hydrochloride (CID 19102619) is 1-phenyl-3-[3-(4-phenylpiperazin-1-yl)propyl]imidazolidin-2-one;hydrochloride.
What is the SMILES notation for 1-phenyl-3-[3-(4-phenylpiperazin-1-yl)propyl]imidazolidin-2-one;hydrochloride?
The canonical SMILES for 1-phenyl-3-[3-(4-phenylpiperazin-1-yl)propyl]imidazolidin-2-one;hydrochloride is Cl.O=C1N(CCCN2CCN(c3ccccc3)CC2)CCN1c1ccccc1.
What is the InChIKey of 1-phenyl-3-[3-(4-phenylpiperazin-1-yl)propyl]imidazolidin-2-one;hydrochloride?
The InChIKey is ORWIQXMGTQPHQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N4O.ClH/c27-22-25(18-19-26(22)21-10-5-2-6-11-21)13-7-12-23-14-16-24(17-15-23)20-8-3-1-4-9-20;/h1-6,8-11H,7,12-19H2;1H.
What are the key properties of 1-phenyl-3-[3-(4-phenylpiperazin-1-yl)propyl]imidazolidin-2-one;hydrochloride?
1-phenyl-3-[3-(4-phenylpiperazin-1-yl)propyl]imidazolidin-2-one;hydrochloride has a molecular weight of 400.95 g/mol, XLogP of 3.56, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-3-[3-(4-phenylpiperazin-1-yl)propyl]imidazolidin-2-one;hydrochloride is sourced from PubChem (CID 19102619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).