5-propyl-3-[[5-(propylamino)pyrazin-2-yl]methyl]imidazolidine-2,4-dione

C14H21N5O2 — CID 103057085

IUPAC5-propyl-3-[[5-(propylamino)pyrazin-2-yl]methyl]imidazolidine-2,4-dione
SMILESCCCNc1cnc(CN2C(=O)NC(CCC)C2=O)cn1
InChIInChI=1S/C14H21N5O2/c1-3-5-11-13(20)19(14(21)18-11)9-10-7-17-12(8-16-10)15-6-4-2/h7-8,11H,3-6,9H2,1-2H3,(H,15,17)(H,18,21)
InChIKeyRQJHJRVDADZCII-UHFFFAOYSA-N
MW291.36 g/mol
LogP1.52
Rot. Bonds7

About 5-propyl-3-[[5-(propylamino)pyrazin-2-yl]methyl]imidazolidine-2,4-dione

5-propyl-3-[[5-(propylamino)pyrazin-2-yl]methyl]imidazolidine-2,4-dione (PubChem CID 103057085) has the molecular formula C14H21N5O2 and a molecular weight of 291.36 g/mol. Its IUPAC name is 5-propyl-3-[[5-(propylamino)pyrazin-2-yl]methyl]imidazolidine-2,4-dione.

Molecular Properties

Compound Name5-propyl-3-[[5-(propylamino)pyrazin-2-yl]methyl]imidazolidine-2,4-dione
PubChem CID103057085
Molecular FormulaC14H21N5O2
Molecular Weight291.36 g/mol
Exact Mass291.17
IUPAC Name5-propyl-3-[[5-(propylamino)pyrazin-2-yl]methyl]imidazolidine-2,4-dione
SMILESCCCNc1cnc(CN2C(=O)NC(CCC)C2=O)cn1
InChIInChI=1S/C14H21N5O2/c1-3-5-11-13(20)19(14(21)18-11)9-10-7-17-12(8-16-10)15-6-4-2/h7-8,11H,3-6,9H2,1-2H3,(H,15,17)(H,18,21)
InChIKeyRQJHJRVDADZCII-UHFFFAOYSA-N
XLogP1.52
TPSA87.22 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.36
LogP ≤ 51.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 5-propyl-3-[[5-(propylamino)pyrazin-2-yl]methyl]imidazolidine-2,4-dione with MolForge

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Related Compounds

3-[[5-(propylamino)pyrazin-2-yl]methyl]-3-azabicyclo[3.1.0]hexane-2,4-dione
CID 103057419
1-ethyl-4-[[5-(propylamino)pyrazin-2-yl]methyl]piperazine-2,3-dione
CID 103056990
5-propyl-3-[[5-(propylamino)thiadiazol-4-yl]methyl]imidazolidine-2,4-dione
CID 62207477
5-[(4-propan-2-ylpiperidin-1-yl)methyl]-N-propylpyrazin-2-amine
CID 103502336
3-ethyl-4-[[5-(propylamino)pyrazin-2-yl]methyl]piperazine-2,6-dione
CID 103056602
3-[(6-amino-2-pyridinyl)methyl]-5-propylimidazolidine-2,4-dione
CID 79230999
5-(8-oxa-3-azabicyclo[3.2.1]octan-3-ylmethyl)-N-propylpyrazin-2-amine
CID 103056605
N-methyl-1-[[5-(propylamino)pyrazin-2-yl]methyl]piperidine-4-carboxamide
CID 103056085
N-propyl-5-[(3,4,5-trimethylpiperazin-1-yl)methyl]pyrazin-2-amine
CID 103056905
5-[(2,3-dimethylpiperidin-1-yl)methyl]-N-propylpyrazin-2-amine
CID 103055739
2-[[5-(ethylamino)pyrazin-2-yl]methyl]-5-methyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[c]pyrrole-1,3-dione
CID 103057808
N-propyl-5-(propylaminomethyl)pyrazin-2-amine
CID 107380778

Frequently Asked Questions

What is the IUPAC name of 5-propyl-3-[[5-(propylamino)pyrazin-2-yl]methyl]imidazolidine-2,4-dione?
The IUPAC name of 5-propyl-3-[[5-(propylamino)pyrazin-2-yl]methyl]imidazolidine-2,4-dione (CID 103057085) is 5-propyl-3-[[5-(propylamino)pyrazin-2-yl]methyl]imidazolidine-2,4-dione.
What is the SMILES notation for 5-propyl-3-[[5-(propylamino)pyrazin-2-yl]methyl]imidazolidine-2,4-dione?
The canonical SMILES for 5-propyl-3-[[5-(propylamino)pyrazin-2-yl]methyl]imidazolidine-2,4-dione is CCCNc1cnc(CN2C(=O)NC(CCC)C2=O)cn1.
What is the InChIKey of 5-propyl-3-[[5-(propylamino)pyrazin-2-yl]methyl]imidazolidine-2,4-dione?
The InChIKey is RQJHJRVDADZCII-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5O2/c1-3-5-11-13(20)19(14(21)18-11)9-10-7-17-12(8-16-10)15-6-4-2/h7-8,11H,3-6,9H2,1-2H3,(H,15,17)(H,18,21).
What are the key properties of 5-propyl-3-[[5-(propylamino)pyrazin-2-yl]methyl]imidazolidine-2,4-dione?
5-propyl-3-[[5-(propylamino)pyrazin-2-yl]methyl]imidazolidine-2,4-dione has a molecular weight of 291.36 g/mol, XLogP of 1.52, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-propyl-3-[[5-(propylamino)pyrazin-2-yl]methyl]imidazolidine-2,4-dione is sourced from PubChem (CID 103057085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).