(5R)-5-ethyl-5-[1-(2-methyl-6-propylpyrimidin-4-yl)piperidin-4-yl]imidazolidine-2,4-dione

C18H27N5O2 — CID 95206096

IUPAC(5R)-5-ethyl-5-[1-(2-methyl-6-propylpyrimidin-4-yl)piperidin-4-yl]imidazolidine-2,4-dione
SMILESCCCc1cc(N2CCC([C@@]3(CC)NC(=O)NC3=O)CC2)nc(C)n1
InChIInChI=1S/C18H27N5O2/c1-4-6-14-11-15(20-12(3)19-14)23-9-7-13(8-10-23)18(5-2)16(24)21-17(25)22-18/h11,13H,4-10H2,1-3H3,(H2,21,22,24,25)/t18-/m1/s1
InChIKeyWAVNHCZMHHBVDP-GOSISDBHSA-N
MW345.45 g/mol
LogP1.94
Rot. Bonds5

About (5R)-5-ethyl-5-[1-(2-methyl-6-propylpyrimidin-4-yl)piperidin-4-yl]imidazolidine-2,4-dione

(5R)-5-ethyl-5-[1-(2-methyl-6-propylpyrimidin-4-yl)piperidin-4-yl]imidazolidine-2,4-dione (PubChem CID 95206096) has the molecular formula C18H27N5O2 and a molecular weight of 345.45 g/mol. Its IUPAC name is (5R)-5-ethyl-5-[1-(2-methyl-6-propylpyrimidin-4-yl)piperidin-4-yl]imidazolidine-2,4-dione.

Molecular Properties

Compound Name(5R)-5-ethyl-5-[1-(2-methyl-6-propylpyrimidin-4-yl)piperidin-4-yl]imidazolidine-2,4-dione
PubChem CID95206096
Molecular FormulaC18H27N5O2
Molecular Weight345.45 g/mol
Exact Mass345.22
IUPAC Name(5R)-5-ethyl-5-[1-(2-methyl-6-propylpyrimidin-4-yl)piperidin-4-yl]imidazolidine-2,4-dione
SMILESCCCc1cc(N2CCC([C@@]3(CC)NC(=O)NC3=O)CC2)nc(C)n1
InChIInChI=1S/C18H27N5O2/c1-4-6-14-11-15(20-12(3)19-14)23-9-7-13(8-10-23)18(5-2)16(24)21-17(25)22-18/h11,13H,4-10H2,1-3H3,(H2,21,22,24,25)/t18-/m1/s1
InChIKeyWAVNHCZMHHBVDP-GOSISDBHSA-N
XLogP1.94
TPSA87.22 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.45
LogP ≤ 51.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze (5R)-5-ethyl-5-[1-(2-methyl-6-propylpyrimidin-4-yl)piperidin-4-yl]imidazolidine-2,4-dione with MolForge

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Related Compounds

4-[[1-(2-methyl-6-propylpyrimidin-4-yl)piperidin-4-yl]amino]cyclohexan-1-ol
CID 72849212
5-[1-(5-ethyl-2-methylpyrimidin-4-yl)piperidin-4-yl]-5-propylimidazolidine-2,4-dione
CID 56714796
(5R)-5-cyclohexyl-5-ethylimidazolidine-2,4-dione
CID 92532345
N-[(3-methyloxetan-3-yl)methyl]-1-(2-methyl-6-propylpyrimidin-4-yl)piperidin-4-amine
CID 72930583
2-[4-(2,5-dioxo-4-propylimidazolidin-4-yl)piperidin-1-yl]-4,6-dimethylpyridine-3-carbonitrile
CID 56723617
(5S)-5-[1-(2,5-dimethylpyrimidin-4-yl)piperidin-4-yl]-5-[(4-fluorophenyl)methyl]imidazolidine-2,4-dione
CID 95215117
(3S)-1-(4-fluorophenyl)-3-[4-(2-methyl-6-propylpyrimidin-4-yl)piperazin-1-yl]pyrrolidine-2,5-dione
CID 7348436
(5S)-5-ethyl-5-[1-(3-methylpyridine-2-carbonyl)piperidin-4-yl]imidazolidine-2,4-dione
CID 95211410
N-[1-(2-ethyl-1,2,4-triazol-3-yl)ethyl]-1-(2-methyl-6-propylpyrimidin-4-yl)piperidin-4-amine
CID 72865903
(1S,9S)-11-(2-methyl-6-propylpyrimidin-4-yl)-8-oxa-2,3,4,11-tetrazatricyclo[7.4.0.02,6]trideca-3,5-diene
CID 118786507
N-(isoquinolin-5-ylmethyl)-N-methyl-1-(2-methyl-6-propylpyrimidin-4-yl)piperidin-4-amine
CID 72862416
(5R)-5-ethyl-5-[1-[2-(2-ethylimidazol-1-yl)acetyl]piperidin-4-yl]imidazolidine-2,4-dione
CID 95198121

Frequently Asked Questions

What is the IUPAC name of (5R)-5-ethyl-5-[1-(2-methyl-6-propylpyrimidin-4-yl)piperidin-4-yl]imidazolidine-2,4-dione?
The IUPAC name of (5R)-5-ethyl-5-[1-(2-methyl-6-propylpyrimidin-4-yl)piperidin-4-yl]imidazolidine-2,4-dione (CID 95206096) is (5R)-5-ethyl-5-[1-(2-methyl-6-propylpyrimidin-4-yl)piperidin-4-yl]imidazolidine-2,4-dione.
What is the SMILES notation for (5R)-5-ethyl-5-[1-(2-methyl-6-propylpyrimidin-4-yl)piperidin-4-yl]imidazolidine-2,4-dione?
The canonical SMILES for (5R)-5-ethyl-5-[1-(2-methyl-6-propylpyrimidin-4-yl)piperidin-4-yl]imidazolidine-2,4-dione is CCCc1cc(N2CCC([C@@]3(CC)NC(=O)NC3=O)CC2)nc(C)n1.
What is the InChIKey of (5R)-5-ethyl-5-[1-(2-methyl-6-propylpyrimidin-4-yl)piperidin-4-yl]imidazolidine-2,4-dione?
The InChIKey is WAVNHCZMHHBVDP-GOSISDBHSA-N. The full InChI is InChI=1S/C18H27N5O2/c1-4-6-14-11-15(20-12(3)19-14)23-9-7-13(8-10-23)18(5-2)16(24)21-17(25)22-18/h11,13H,4-10H2,1-3H3,(H2,21,22,24,25)/t18-/m1/s1.
What are the key properties of (5R)-5-ethyl-5-[1-(2-methyl-6-propylpyrimidin-4-yl)piperidin-4-yl]imidazolidine-2,4-dione?
(5R)-5-ethyl-5-[1-(2-methyl-6-propylpyrimidin-4-yl)piperidin-4-yl]imidazolidine-2,4-dione has a molecular weight of 345.45 g/mol, XLogP of 1.94, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-5-ethyl-5-[1-(2-methyl-6-propylpyrimidin-4-yl)piperidin-4-yl]imidazolidine-2,4-dione is sourced from PubChem (CID 95206096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).