5-methyl-5-[4-[4-[(5-methyl-2-pyridinyl)amino]piperidine-1-carbonyl]phenyl]imidazolidine-2,4-dione

C22H25N5O3 — CID 134494989

IUPAC5-methyl-5-[4-[4-[(5-methyl-2-pyridinyl)amino]piperidine-1-carbonyl]phenyl]imidazolidine-2,4-dione
SMILESCc1ccc(NC2CCN(C(=O)c3ccc(C4(C)NC(=O)NC4=O)cc3)CC2)nc1
InChIInChI=1S/C22H25N5O3/c1-14-3-8-18(23-13-14)24-17-9-11-27(12-10-17)19(28)15-4-6-16(7-5-15)22(2)20(29)25-21(30)26-22/h3-8,13,17H,9-12H2,1-2H3,(H,23,24)(H2,25,26,29,30)
InChIKeyDQCPHPXUMUFHAM-UHFFFAOYSA-N
MW407.47 g/mol
LogP2.16
Rot. Bonds4

About 5-methyl-5-[4-[4-[(5-methyl-2-pyridinyl)amino]piperidine-1-carbonyl]phenyl]imidazolidine-2,4-dione

5-methyl-5-[4-[4-[(5-methyl-2-pyridinyl)amino]piperidine-1-carbonyl]phenyl]imidazolidine-2,4-dione (PubChem CID 134494989) has the molecular formula C22H25N5O3 and a molecular weight of 407.47 g/mol. Its IUPAC name is 5-methyl-5-[4-[4-[(5-methyl-2-pyridinyl)amino]piperidine-1-carbonyl]phenyl]imidazolidine-2,4-dione.

Molecular Properties

Compound Name5-methyl-5-[4-[4-[(5-methyl-2-pyridinyl)amino]piperidine-1-carbonyl]phenyl]imidazolidine-2,4-dione
PubChem CID134494989
Molecular FormulaC22H25N5O3
Molecular Weight407.47 g/mol
Exact Mass407.20
IUPAC Name5-methyl-5-[4-[4-[(5-methyl-2-pyridinyl)amino]piperidine-1-carbonyl]phenyl]imidazolidine-2,4-dione
SMILESCc1ccc(NC2CCN(C(=O)c3ccc(C4(C)NC(=O)NC4=O)cc3)CC2)nc1
InChIInChI=1S/C22H25N5O3/c1-14-3-8-18(23-13-14)24-17-9-11-27(12-10-17)19(28)15-4-6-16(7-5-15)22(2)20(29)25-21(30)26-22/h3-8,13,17H,9-12H2,1-2H3,(H,23,24)(H2,25,26,29,30)
InChIKeyDQCPHPXUMUFHAM-UHFFFAOYSA-N
XLogP2.16
TPSA103.43 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500407.47
LogP ≤ 52.16
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}

Analyze 5-methyl-5-[4-[4-[(5-methyl-2-pyridinyl)amino]piperidine-1-carbonyl]phenyl]imidazolidine-2,4-dione with MolForge

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Related Compounds

(5R)-5-[4-[(3S)-3-[(3,5-dimethyl-2-pyridinyl)amino]pyrrolidine-1-carbonyl]phenyl]-5-methylimidazolidine-2,4-dione
CID 134495091
(5S)-5-methyl-5-[4-[(3R)-3-methylpiperidine-1-carbonyl]phenyl]imidazolidine-2,4-dione
CID 95971979
(5R)-5-[4-[4-[(5-methyl-2-pyridinyl)oxy]piperidine-1-carbonyl]phenyl]-5-propan-2-ylimidazolidine-2,4-dione
CID 134495001
5-[4-[3-[(3,5-dimethyl-2-pyridinyl)amino]pyrrolidine-1-carbonyl]phenyl]-5-ethylimidazolidine-2,4-dione
CID 134494383
5-[4-[3-[(3,5-dimethyl-2-pyridinyl)amino]pyrrolidine-1-carbonyl]phenyl]-5-(fluoromethyl)imidazolidine-2,4-dione
CID 134494613
(5R)-5-[4-[4-(5-methylpyridine-2-carbonyl)piperidine-1-carbonyl]phenyl]-5-propan-2-ylimidazolidine-2,4-dione
CID 134494258
5-[4-[4-[5-(2,4-dimethylphenyl)-1,3,4-oxadiazol-2-yl]piperidine-1-carbonyl]phenyl]-5-methylimidazolidine-2,4-dione
CID 134494385
(5R)-5-[4-[(3R)-3-aminopiperidine-1-carbonyl]phenyl]-5-methylimidazolidine-2,4-dione
CID 124593322
(5R)-5-[4-[(3R,5R)-3,5-dimethylpiperazine-1-carbonyl]phenyl]-5-methylimidazolidine-2,4-dione
CID 124589328
(5R)-5-[4-[(3S)-3-[(1S)-1-aminoethyl]piperidine-1-carbonyl]phenyl]-5-methylimidazolidine-2,4-dione
CID 124690838
5-[4-[(2R,6S)-2,6-dimethylmorpholine-4-carbonyl]phenyl]-5-methylimidazolidine-2,4-dione
CID 127758807
(E)-N-hydroxy-3-[6-[[1-(4-methylbenzoyl)piperidin-4-yl]amino]-3-pyridinyl]prop-2-enamide
CID 87637895

Frequently Asked Questions

What is the IUPAC name of 5-methyl-5-[4-[4-[(5-methyl-2-pyridinyl)amino]piperidine-1-carbonyl]phenyl]imidazolidine-2,4-dione?
The IUPAC name of 5-methyl-5-[4-[4-[(5-methyl-2-pyridinyl)amino]piperidine-1-carbonyl]phenyl]imidazolidine-2,4-dione (CID 134494989) is 5-methyl-5-[4-[4-[(5-methyl-2-pyridinyl)amino]piperidine-1-carbonyl]phenyl]imidazolidine-2,4-dione.
What is the SMILES notation for 5-methyl-5-[4-[4-[(5-methyl-2-pyridinyl)amino]piperidine-1-carbonyl]phenyl]imidazolidine-2,4-dione?
The canonical SMILES for 5-methyl-5-[4-[4-[(5-methyl-2-pyridinyl)amino]piperidine-1-carbonyl]phenyl]imidazolidine-2,4-dione is Cc1ccc(NC2CCN(C(=O)c3ccc(C4(C)NC(=O)NC4=O)cc3)CC2)nc1.
What is the InChIKey of 5-methyl-5-[4-[4-[(5-methyl-2-pyridinyl)amino]piperidine-1-carbonyl]phenyl]imidazolidine-2,4-dione?
The InChIKey is DQCPHPXUMUFHAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25N5O3/c1-14-3-8-18(23-13-14)24-17-9-11-27(12-10-17)19(28)15-4-6-16(7-5-15)22(2)20(29)25-21(30)26-22/h3-8,13,17H,9-12H2,1-2H3,(H,23,24)(H2,25,26,29,30).
What are the key properties of 5-methyl-5-[4-[4-[(5-methyl-2-pyridinyl)amino]piperidine-1-carbonyl]phenyl]imidazolidine-2,4-dione?
5-methyl-5-[4-[4-[(5-methyl-2-pyridinyl)amino]piperidine-1-carbonyl]phenyl]imidazolidine-2,4-dione has a molecular weight of 407.47 g/mol, XLogP of 2.16, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-5-[4-[4-[(5-methyl-2-pyridinyl)amino]piperidine-1-carbonyl]phenyl]imidazolidine-2,4-dione is sourced from PubChem (CID 134494989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).