[(3S)-1-[(3R)-oxolane-3-carbonyl]pyrrolidin-3-yl]urea

C10H17N3O3 — CID 177272383

IUPAC[(3S)-1-[(3R)-oxolane-3-carbonyl]pyrrolidin-3-yl]urea
SMILESNC(=O)N[C@H]1CCN(C(=O)[C@@H]2CCOC2)C1
InChIInChI=1S/C10H17N3O3/c11-10(15)12-8-1-3-13(5-8)9(14)7-2-4-16-6-7/h7-8H,1-6H2,(H3,11,12,15)/t7-,8+/m1/s1
InChIKeyUYZLUBSJEPKMTC-SFYZADRCSA-N
MW227.26 g/mol
LogP-0.71
Rot. Bonds2

About [(3S)-1-[(3R)-oxolane-3-carbonyl]pyrrolidin-3-yl]urea

[(3S)-1-[(3R)-oxolane-3-carbonyl]pyrrolidin-3-yl]urea (PubChem CID 177272383) has the molecular formula C10H17N3O3 and a molecular weight of 227.26 g/mol. Its IUPAC name is [(3S)-1-[(3R)-oxolane-3-carbonyl]pyrrolidin-3-yl]urea.

Molecular Properties

Compound Name[(3S)-1-[(3R)-oxolane-3-carbonyl]pyrrolidin-3-yl]urea
PubChem CID177272383
Molecular FormulaC10H17N3O3
Molecular Weight227.26 g/mol
Exact Mass227.13
IUPAC Name[(3S)-1-[(3R)-oxolane-3-carbonyl]pyrrolidin-3-yl]urea
SMILESNC(=O)N[C@H]1CCN(C(=O)[C@@H]2CCOC2)C1
InChIInChI=1S/C10H17N3O3/c11-10(15)12-8-1-3-13(5-8)9(14)7-2-4-16-6-7/h7-8H,1-6H2,(H3,11,12,15)/t7-,8+/m1/s1
InChIKeyUYZLUBSJEPKMTC-SFYZADRCSA-N
XLogP-0.71
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.26
LogP ≤ 5-0.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze [(3S)-1-[(3R)-oxolane-3-carbonyl]pyrrolidin-3-yl]urea with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [(3S)-1-[(3R)-oxolane-3-carbonyl]pyrrolidin-3-yl]urea?
The IUPAC name of [(3S)-1-[(3R)-oxolane-3-carbonyl]pyrrolidin-3-yl]urea (CID 177272383) is [(3S)-1-[(3R)-oxolane-3-carbonyl]pyrrolidin-3-yl]urea.
What is the SMILES notation for [(3S)-1-[(3R)-oxolane-3-carbonyl]pyrrolidin-3-yl]urea?
The canonical SMILES for [(3S)-1-[(3R)-oxolane-3-carbonyl]pyrrolidin-3-yl]urea is NC(=O)N[C@H]1CCN(C(=O)[C@@H]2CCOC2)C1.
What is the InChIKey of [(3S)-1-[(3R)-oxolane-3-carbonyl]pyrrolidin-3-yl]urea?
The InChIKey is UYZLUBSJEPKMTC-SFYZADRCSA-N. The full InChI is InChI=1S/C10H17N3O3/c11-10(15)12-8-1-3-13(5-8)9(14)7-2-4-16-6-7/h7-8H,1-6H2,(H3,11,12,15)/t7-,8+/m1/s1.
What are the key properties of [(3S)-1-[(3R)-oxolane-3-carbonyl]pyrrolidin-3-yl]urea?
[(3S)-1-[(3R)-oxolane-3-carbonyl]pyrrolidin-3-yl]urea has a molecular weight of 227.26 g/mol, XLogP of -0.71, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(3S)-1-[(3R)-oxolane-3-carbonyl]pyrrolidin-3-yl]urea is sourced from PubChem (CID 177272383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).