1-[2-methyl-5-[(2S)-4-methyl-2-phenylpiperazine-1-carbonyl]phenyl]imidazolidin-2-one

C22H26N4O2 — CID 97156710

IUPAC1-[2-methyl-5-[(2S)-4-methyl-2-phenylpiperazine-1-carbonyl]phenyl]imidazolidin-2-one
SMILESCc1ccc(C(=O)N2CCN(C)C[C@@H]2c2ccccc2)cc1N1CCNC1=O
InChIInChI=1S/C22H26N4O2/c1-16-8-9-18(14-19(16)26-11-10-23-22(26)28)21(27)25-13-12-24(2)15-20(25)17-6-4-3-5-7-17/h3-9,14,20H,10-13,15H2,1-2H3,(H,23,28)/t20-/m1/s1
InChIKeyWQMKDBISIIDCEX-HXUWFJFHSA-N
MW378.48 g/mol
LogP2.65
Rot. Bonds3

About 1-[2-methyl-5-[(2S)-4-methyl-2-phenylpiperazine-1-carbonyl]phenyl]imidazolidin-2-one

1-[2-methyl-5-[(2S)-4-methyl-2-phenylpiperazine-1-carbonyl]phenyl]imidazolidin-2-one (PubChem CID 97156710) has the molecular formula C22H26N4O2 and a molecular weight of 378.48 g/mol. Its IUPAC name is 1-[2-methyl-5-[(2S)-4-methyl-2-phenylpiperazine-1-carbonyl]phenyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[2-methyl-5-[(2S)-4-methyl-2-phenylpiperazine-1-carbonyl]phenyl]imidazolidin-2-one
PubChem CID97156710
Molecular FormulaC22H26N4O2
Molecular Weight378.48 g/mol
Exact Mass378.21
IUPAC Name1-[2-methyl-5-[(2S)-4-methyl-2-phenylpiperazine-1-carbonyl]phenyl]imidazolidin-2-one
SMILESCc1ccc(C(=O)N2CCN(C)C[C@@H]2c2ccccc2)cc1N1CCNC1=O
InChIInChI=1S/C22H26N4O2/c1-16-8-9-18(14-19(16)26-11-10-23-22(26)28)21(27)25-13-12-24(2)15-20(25)17-6-4-3-5-7-17/h3-9,14,20H,10-13,15H2,1-2H3,(H,23,28)/t20-/m1/s1
InChIKeyWQMKDBISIIDCEX-HXUWFJFHSA-N
XLogP2.65
TPSA55.89 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.48
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3-methoxy-4-methylphenyl)-[(2R)-4-methyl-2-phenylpiperazin-1-yl]methanone
CID 25489891
(4-fluorophenyl)-[(2S)-4-methyl-2-phenylpiperazin-1-yl]methanone
CID 37332392
1-[5-(3-amino-4-phenylpyrrolidine-1-carbonyl)-2-methylphenyl]imidazolidin-2-one
CID 156606116
1-[4-[(2S)-2,4-dimethylpiperazine-1-carbonyl]-2-methylphenyl]imidazolidin-2-one
CID 97068187
(4-methyl-2-phenylpiperazin-1-yl)-phenylmethanone
CID 4069484
(2R)-1-[4-methyl-3-(2-oxoimidazolidin-1-yl)benzoyl]pyrrolidine-2-carboxylic acid
CID 97206305
2-(4-methyl-2-phenylpiperazine-1-carbonyl)fluoren-9-one
CID 134042687
(2,3-dimethyl-1H-indol-5-yl)-[(2S)-4-methyl-2-phenylpiperazin-1-yl]methanone
CID 37332978
(3-chlorophenyl)-(4-methyl-2-phenylpiperazin-1-yl)methanone
CID 42891355
1-[2-methyl-5-[(3R)-3-(3-methylphenyl)piperidine-1-carbonyl]phenyl]imidazolidin-2-one
CID 97127410
(4-methoxyphenyl)-[(2S)-4-methyl-2-phenylpiperazin-1-yl]methanone
CID 37332417
1-(2-hydroxyethyl)-5-(4-methyl-2-phenylpiperazine-1-carbonyl)pyridin-2-one
CID 155962442

Frequently Asked Questions

What is the IUPAC name of 1-[2-methyl-5-[(2S)-4-methyl-2-phenylpiperazine-1-carbonyl]phenyl]imidazolidin-2-one?
The IUPAC name of 1-[2-methyl-5-[(2S)-4-methyl-2-phenylpiperazine-1-carbonyl]phenyl]imidazolidin-2-one (CID 97156710) is 1-[2-methyl-5-[(2S)-4-methyl-2-phenylpiperazine-1-carbonyl]phenyl]imidazolidin-2-one.
What is the SMILES notation for 1-[2-methyl-5-[(2S)-4-methyl-2-phenylpiperazine-1-carbonyl]phenyl]imidazolidin-2-one?
The canonical SMILES for 1-[2-methyl-5-[(2S)-4-methyl-2-phenylpiperazine-1-carbonyl]phenyl]imidazolidin-2-one is Cc1ccc(C(=O)N2CCN(C)C[C@@H]2c2ccccc2)cc1N1CCNC1=O.
What is the InChIKey of 1-[2-methyl-5-[(2S)-4-methyl-2-phenylpiperazine-1-carbonyl]phenyl]imidazolidin-2-one?
The InChIKey is WQMKDBISIIDCEX-HXUWFJFHSA-N. The full InChI is InChI=1S/C22H26N4O2/c1-16-8-9-18(14-19(16)26-11-10-23-22(26)28)21(27)25-13-12-24(2)15-20(25)17-6-4-3-5-7-17/h3-9,14,20H,10-13,15H2,1-2H3,(H,23,28)/t20-/m1/s1.
What are the key properties of 1-[2-methyl-5-[(2S)-4-methyl-2-phenylpiperazine-1-carbonyl]phenyl]imidazolidin-2-one?
1-[2-methyl-5-[(2S)-4-methyl-2-phenylpiperazine-1-carbonyl]phenyl]imidazolidin-2-one has a molecular weight of 378.48 g/mol, XLogP of 2.65, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-methyl-5-[(2S)-4-methyl-2-phenylpiperazine-1-carbonyl]phenyl]imidazolidin-2-one is sourced from PubChem (CID 97156710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).