N-(oxolan-3-yloxy)-1-phenylpyrrolidine-2-carboxamide

C15H20N2O3 — CID 154863408

IUPACN-(oxolan-3-yloxy)-1-phenylpyrrolidine-2-carboxamide
SMILESO=C(NOC1CCOC1)C1CCCN1c1ccccc1
InChIInChI=1S/C15H20N2O3/c18-15(16-20-13-8-10-19-11-13)14-7-4-9-17(14)12-5-2-1-3-6-12/h1-3,5-6,13-14H,4,7-11H2,(H,16,18)
InChIKeyLHULJVRIXDJGON-UHFFFAOYSA-N
MW276.34 g/mol
LogP1.49
Rot. Bonds4

About N-(oxolan-3-yloxy)-1-phenylpyrrolidine-2-carboxamide

N-(oxolan-3-yloxy)-1-phenylpyrrolidine-2-carboxamide (PubChem CID 154863408) has the molecular formula C15H20N2O3 and a molecular weight of 276.34 g/mol. Its IUPAC name is N-(oxolan-3-yloxy)-1-phenylpyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-(oxolan-3-yloxy)-1-phenylpyrrolidine-2-carboxamide
PubChem CID154863408
Molecular FormulaC15H20N2O3
Molecular Weight276.34 g/mol
Exact Mass276.15
IUPAC NameN-(oxolan-3-yloxy)-1-phenylpyrrolidine-2-carboxamide
SMILESO=C(NOC1CCOC1)C1CCCN1c1ccccc1
InChIInChI=1S/C15H20N2O3/c18-15(16-20-13-8-10-19-11-13)14-7-4-9-17(14)12-5-2-1-3-6-12/h1-3,5-6,13-14H,4,7-11H2,(H,16,18)
InChIKeyLHULJVRIXDJGON-UHFFFAOYSA-N
XLogP1.49
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(2S)-1-(cyclopropanecarbonyl)-N-(oxolan-3-yloxy)pyrrolidine-2-carboxamide
CID 154865192
N-(diaminomethylidene)-1-phenylpyrrolidine-2-carboxamide
CID 54358653
cyclopropyl-[(2R)-1-phenylpyrrolidin-2-yl]methanone
CID 173145770
N-cyclopentyloxy-1-pyrimidin-2-ylpyrrolidine-2-carboxamide
CID 83216321
ethyl 4-(1-phenylpyrrolidine-2-carbonyl)piperazine-1-carboxylate
CID 15158260
2-hydroxy-4-oxo-4-(1-phenylpyrrolidin-2-yl)but-2-enoic acid
CID 174437161
[(2S)-1-phenylpyrrolidine-2-carbonyl] sulfite
CID 91386737
trans-(1R,2R)-2-methyl-N-(oxolan-3-yloxy)cyclopropane-1-carboxamide
CID 130673406
N-(1,5-dimethyl-1,2,4-triazol-3-yl)-1-phenylpyrrolidine-2-carboxamide
CID 128532338
1-[4-[(4-phenoxyphenyl)carbamoylamino]phenyl]pyrrolidine-2-carboxamide
CID 91807695
(2S)-N-benzyl-1-(4-chlorophenyl)pyrrolidine-2-carboxamide
CID 90115301
3-methyl-1-(1-phenylpyrrolidin-2-yl)butan-1-one
CID 132966507

Frequently Asked Questions

What is the IUPAC name of N-(oxolan-3-yloxy)-1-phenylpyrrolidine-2-carboxamide?
The IUPAC name of N-(oxolan-3-yloxy)-1-phenylpyrrolidine-2-carboxamide (CID 154863408) is N-(oxolan-3-yloxy)-1-phenylpyrrolidine-2-carboxamide.
What is the SMILES notation for N-(oxolan-3-yloxy)-1-phenylpyrrolidine-2-carboxamide?
The canonical SMILES for N-(oxolan-3-yloxy)-1-phenylpyrrolidine-2-carboxamide is O=C(NOC1CCOC1)C1CCCN1c1ccccc1.
What is the InChIKey of N-(oxolan-3-yloxy)-1-phenylpyrrolidine-2-carboxamide?
The InChIKey is LHULJVRIXDJGON-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O3/c18-15(16-20-13-8-10-19-11-13)14-7-4-9-17(14)12-5-2-1-3-6-12/h1-3,5-6,13-14H,4,7-11H2,(H,16,18).
What are the key properties of N-(oxolan-3-yloxy)-1-phenylpyrrolidine-2-carboxamide?
N-(oxolan-3-yloxy)-1-phenylpyrrolidine-2-carboxamide has a molecular weight of 276.34 g/mol, XLogP of 1.49, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(oxolan-3-yloxy)-1-phenylpyrrolidine-2-carboxamide is sourced from PubChem (CID 154863408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).