(5S)-3-[[cyclohexyl(methyl)amino]methyl]-5-cyclopropyl-5-methylimidazolidine-2,4-dione

C15H25N3O2 — CID 41411892

IUPAC(5S)-3-[[cyclohexyl(methyl)amino]methyl]-5-cyclopropyl-5-methylimidazolidine-2,4-dione
SMILESCN(CN1C(=O)N[C@@](C)(C2CC2)C1=O)C1CCCCC1
InChIInChI=1S/C15H25N3O2/c1-15(11-8-9-11)13(19)18(14(20)16-15)10-17(2)12-6-4-3-5-7-12/h11-12H,3-10H2,1-2H3,(H,16,20)/t15-/m0/s1
InChIKeySXRMLCSEQYSWNA-HNNXBMFYSA-N
MW279.38 g/mol
LogP1.93
Rot. Bonds4

About (5S)-3-[[cyclohexyl(methyl)amino]methyl]-5-cyclopropyl-5-methylimidazolidine-2,4-dione

(5S)-3-[[cyclohexyl(methyl)amino]methyl]-5-cyclopropyl-5-methylimidazolidine-2,4-dione (PubChem CID 41411892) has the molecular formula C15H25N3O2 and a molecular weight of 279.38 g/mol. Its IUPAC name is (5S)-3-[[cyclohexyl(methyl)amino]methyl]-5-cyclopropyl-5-methylimidazolidine-2,4-dione.

Molecular Properties

Compound Name(5S)-3-[[cyclohexyl(methyl)amino]methyl]-5-cyclopropyl-5-methylimidazolidine-2,4-dione
PubChem CID41411892
Molecular FormulaC15H25N3O2
Molecular Weight279.38 g/mol
Exact Mass279.19
IUPAC Name(5S)-3-[[cyclohexyl(methyl)amino]methyl]-5-cyclopropyl-5-methylimidazolidine-2,4-dione
SMILESCN(CN1C(=O)N[C@@](C)(C2CC2)C1=O)C1CCCCC1
InChIInChI=1S/C15H25N3O2/c1-15(11-8-9-11)13(19)18(14(20)16-15)10-17(2)12-6-4-3-5-7-12/h11-12H,3-10H2,1-2H3,(H,16,20)/t15-/m0/s1
InChIKeySXRMLCSEQYSWNA-HNNXBMFYSA-N
XLogP1.93
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (5S)-3-[[cyclohexyl(methyl)amino]methyl]-5-cyclopropyl-5-methylimidazolidine-2,4-dione?
The IUPAC name of (5S)-3-[[cyclohexyl(methyl)amino]methyl]-5-cyclopropyl-5-methylimidazolidine-2,4-dione (CID 41411892) is (5S)-3-[[cyclohexyl(methyl)amino]methyl]-5-cyclopropyl-5-methylimidazolidine-2,4-dione.
What is the SMILES notation for (5S)-3-[[cyclohexyl(methyl)amino]methyl]-5-cyclopropyl-5-methylimidazolidine-2,4-dione?
The canonical SMILES for (5S)-3-[[cyclohexyl(methyl)amino]methyl]-5-cyclopropyl-5-methylimidazolidine-2,4-dione is CN(CN1C(=O)N[C@@](C)(C2CC2)C1=O)C1CCCCC1.
What is the InChIKey of (5S)-3-[[cyclohexyl(methyl)amino]methyl]-5-cyclopropyl-5-methylimidazolidine-2,4-dione?
The InChIKey is SXRMLCSEQYSWNA-HNNXBMFYSA-N. The full InChI is InChI=1S/C15H25N3O2/c1-15(11-8-9-11)13(19)18(14(20)16-15)10-17(2)12-6-4-3-5-7-12/h11-12H,3-10H2,1-2H3,(H,16,20)/t15-/m0/s1.
What are the key properties of (5S)-3-[[cyclohexyl(methyl)amino]methyl]-5-cyclopropyl-5-methylimidazolidine-2,4-dione?
(5S)-3-[[cyclohexyl(methyl)amino]methyl]-5-cyclopropyl-5-methylimidazolidine-2,4-dione has a molecular weight of 279.38 g/mol, XLogP of 1.93, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-3-[[cyclohexyl(methyl)amino]methyl]-5-cyclopropyl-5-methylimidazolidine-2,4-dione is sourced from PubChem (CID 41411892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).