(5R)-5-cyclopropyl-3-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]-5-(3-methylbutyl)imidazolidine-2,4-dione

C17H24N4O3 — CID 124734085

IUPAC(5R)-5-cyclopropyl-3-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]-5-(3-methylbutyl)imidazolidine-2,4-dione
SMILESCC(C)CC[C@]1(C2CC2)NC(=O)N(Cc2noc(C3CC3)n2)C1=O
InChIInChI=1S/C17H24N4O3/c1-10(2)7-8-17(12-5-6-12)15(22)21(16(23)19-17)9-13-18-14(24-20-13)11-3-4-11/h10-12H,3-9H2,1-2H3,(H,19,23)/t17-/m1/s1
InChIKeyLWBNFIHKMUQOCK-QGZVFWFLSA-N
MW332.40 g/mol
LogP2.58
Rot. Bonds7

About (5R)-5-cyclopropyl-3-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]-5-(3-methylbutyl)imidazolidine-2,4-dione

(5R)-5-cyclopropyl-3-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]-5-(3-methylbutyl)imidazolidine-2,4-dione (PubChem CID 124734085) has the molecular formula C17H24N4O3 and a molecular weight of 332.40 g/mol. Its IUPAC name is (5R)-5-cyclopropyl-3-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]-5-(3-methylbutyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name(5R)-5-cyclopropyl-3-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]-5-(3-methylbutyl)imidazolidine-2,4-dione
PubChem CID124734085
Molecular FormulaC17H24N4O3
Molecular Weight332.40 g/mol
Exact Mass332.18
IUPAC Name(5R)-5-cyclopropyl-3-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]-5-(3-methylbutyl)imidazolidine-2,4-dione
SMILESCC(C)CC[C@]1(C2CC2)NC(=O)N(Cc2noc(C3CC3)n2)C1=O
InChIInChI=1S/C17H24N4O3/c1-10(2)7-8-17(12-5-6-12)15(22)21(16(23)19-17)9-13-18-14(24-20-13)11-3-4-11/h10-12H,3-9H2,1-2H3,(H,19,23)/t17-/m1/s1
InChIKeyLWBNFIHKMUQOCK-QGZVFWFLSA-N
XLogP2.58
TPSA88.33 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.40
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (5R)-5-cyclopropyl-3-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]-5-(3-methylbutyl)imidazolidine-2,4-dione?
The IUPAC name of (5R)-5-cyclopropyl-3-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]-5-(3-methylbutyl)imidazolidine-2,4-dione (CID 124734085) is (5R)-5-cyclopropyl-3-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]-5-(3-methylbutyl)imidazolidine-2,4-dione.
What is the SMILES notation for (5R)-5-cyclopropyl-3-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]-5-(3-methylbutyl)imidazolidine-2,4-dione?
The canonical SMILES for (5R)-5-cyclopropyl-3-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]-5-(3-methylbutyl)imidazolidine-2,4-dione is CC(C)CC[C@]1(C2CC2)NC(=O)N(Cc2noc(C3CC3)n2)C1=O.
What is the InChIKey of (5R)-5-cyclopropyl-3-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]-5-(3-methylbutyl)imidazolidine-2,4-dione?
The InChIKey is LWBNFIHKMUQOCK-QGZVFWFLSA-N. The full InChI is InChI=1S/C17H24N4O3/c1-10(2)7-8-17(12-5-6-12)15(22)21(16(23)19-17)9-13-18-14(24-20-13)11-3-4-11/h10-12H,3-9H2,1-2H3,(H,19,23)/t17-/m1/s1.
What are the key properties of (5R)-5-cyclopropyl-3-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]-5-(3-methylbutyl)imidazolidine-2,4-dione?
(5R)-5-cyclopropyl-3-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]-5-(3-methylbutyl)imidazolidine-2,4-dione has a molecular weight of 332.40 g/mol, XLogP of 2.58, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-5-cyclopropyl-3-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]-5-(3-methylbutyl)imidazolidine-2,4-dione is sourced from PubChem (CID 124734085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).