(4R)-2-oxo-N-(3-propan-2-yloxypropyl)imidazolidine-4-carboxamide

C10H19N3O3 — CID 97085402

IUPAC(4R)-2-oxo-N-(3-propan-2-yloxypropyl)imidazolidine-4-carboxamide
SMILESCC(C)OCCCNC(=O)[C@H]1CNC(=O)N1
InChIInChI=1S/C10H19N3O3/c1-7(2)16-5-3-4-11-9(14)8-6-12-10(15)13-8/h7-8H,3-6H2,1-2H3,(H,11,14)(H2,12,13,15)/t8-/m1/s1
InChIKeyBIZPDGLBKHJDLW-MRVPVSSYSA-N
MW229.28 g/mol
LogP-0.40
Rot. Bonds6

About (4R)-2-oxo-N-(3-propan-2-yloxypropyl)imidazolidine-4-carboxamide

(4R)-2-oxo-N-(3-propan-2-yloxypropyl)imidazolidine-4-carboxamide (PubChem CID 97085402) has the molecular formula C10H19N3O3 and a molecular weight of 229.28 g/mol. Its IUPAC name is (4R)-2-oxo-N-(3-propan-2-yloxypropyl)imidazolidine-4-carboxamide.

Molecular Properties

Compound Name(4R)-2-oxo-N-(3-propan-2-yloxypropyl)imidazolidine-4-carboxamide
PubChem CID97085402
Molecular FormulaC10H19N3O3
Molecular Weight229.28 g/mol
Exact Mass229.14
IUPAC Name(4R)-2-oxo-N-(3-propan-2-yloxypropyl)imidazolidine-4-carboxamide
SMILESCC(C)OCCCNC(=O)[C@H]1CNC(=O)N1
InChIInChI=1S/C10H19N3O3/c1-7(2)16-5-3-4-11-9(14)8-6-12-10(15)13-8/h7-8H,3-6H2,1-2H3,(H,11,14)(H2,12,13,15)/t8-/m1/s1
InChIKeyBIZPDGLBKHJDLW-MRVPVSSYSA-N
XLogP-0.40
TPSA79.46 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 5-0.40
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (4R)-2-oxo-N-(3-propan-2-yloxypropyl)imidazolidine-4-carboxamide?
The IUPAC name of (4R)-2-oxo-N-(3-propan-2-yloxypropyl)imidazolidine-4-carboxamide (CID 97085402) is (4R)-2-oxo-N-(3-propan-2-yloxypropyl)imidazolidine-4-carboxamide.
What is the SMILES notation for (4R)-2-oxo-N-(3-propan-2-yloxypropyl)imidazolidine-4-carboxamide?
The canonical SMILES for (4R)-2-oxo-N-(3-propan-2-yloxypropyl)imidazolidine-4-carboxamide is CC(C)OCCCNC(=O)[C@H]1CNC(=O)N1.
What is the InChIKey of (4R)-2-oxo-N-(3-propan-2-yloxypropyl)imidazolidine-4-carboxamide?
The InChIKey is BIZPDGLBKHJDLW-MRVPVSSYSA-N. The full InChI is InChI=1S/C10H19N3O3/c1-7(2)16-5-3-4-11-9(14)8-6-12-10(15)13-8/h7-8H,3-6H2,1-2H3,(H,11,14)(H2,12,13,15)/t8-/m1/s1.
What are the key properties of (4R)-2-oxo-N-(3-propan-2-yloxypropyl)imidazolidine-4-carboxamide?
(4R)-2-oxo-N-(3-propan-2-yloxypropyl)imidazolidine-4-carboxamide has a molecular weight of 229.28 g/mol, XLogP of -0.40, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-2-oxo-N-(3-propan-2-yloxypropyl)imidazolidine-4-carboxamide is sourced from PubChem (CID 97085402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).