N-(1-ethyl-6-oxo-3-pyridinyl)-4-(propylamino)oxolane-3-carboxamide

C15H23N3O3 — CID 66256902

IUPACN-(1-ethyl-6-oxo-3-pyridinyl)-4-(propylamino)oxolane-3-carboxamide
SMILESCCCNC1COCC1C(=O)Nc1ccc(=O)n(CC)c1
InChIInChI=1S/C15H23N3O3/c1-3-7-16-13-10-21-9-12(13)15(20)17-11-5-6-14(19)18(4-2)8-11/h5-6,8,12-13,16H,3-4,7,9-10H2,1-2H3,(H,17,20)
InChIKeyULBBGVUWTOORNX-UHFFFAOYSA-N
MW293.37 g/mol
LogP0.82
Rot. Bonds6

About N-(1-ethyl-6-oxo-3-pyridinyl)-4-(propylamino)oxolane-3-carboxamide

N-(1-ethyl-6-oxo-3-pyridinyl)-4-(propylamino)oxolane-3-carboxamide (PubChem CID 66256902) has the molecular formula C15H23N3O3 and a molecular weight of 293.37 g/mol. Its IUPAC name is N-(1-ethyl-6-oxo-3-pyridinyl)-4-(propylamino)oxolane-3-carboxamide.

Molecular Properties

Compound NameN-(1-ethyl-6-oxo-3-pyridinyl)-4-(propylamino)oxolane-3-carboxamide
PubChem CID66256902
Molecular FormulaC15H23N3O3
Molecular Weight293.37 g/mol
Exact Mass293.17
IUPAC NameN-(1-ethyl-6-oxo-3-pyridinyl)-4-(propylamino)oxolane-3-carboxamide
SMILESCCCNC1COCC1C(=O)Nc1ccc(=O)n(CC)c1
InChIInChI=1S/C15H23N3O3/c1-3-7-16-13-10-21-9-12(13)15(20)17-11-5-6-14(19)18(4-2)8-11/h5-6,8,12-13,16H,3-4,7,9-10H2,1-2H3,(H,17,20)
InChIKeyULBBGVUWTOORNX-UHFFFAOYSA-N
XLogP0.82
TPSA72.36 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 50.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(1-ethyl-6-oxo-3-pyridinyl)-4-(propylamino)oxolane-3-carboxamide?
The IUPAC name of N-(1-ethyl-6-oxo-3-pyridinyl)-4-(propylamino)oxolane-3-carboxamide (CID 66256902) is N-(1-ethyl-6-oxo-3-pyridinyl)-4-(propylamino)oxolane-3-carboxamide.
What is the SMILES notation for N-(1-ethyl-6-oxo-3-pyridinyl)-4-(propylamino)oxolane-3-carboxamide?
The canonical SMILES for N-(1-ethyl-6-oxo-3-pyridinyl)-4-(propylamino)oxolane-3-carboxamide is CCCNC1COCC1C(=O)Nc1ccc(=O)n(CC)c1.
What is the InChIKey of N-(1-ethyl-6-oxo-3-pyridinyl)-4-(propylamino)oxolane-3-carboxamide?
The InChIKey is ULBBGVUWTOORNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O3/c1-3-7-16-13-10-21-9-12(13)15(20)17-11-5-6-14(19)18(4-2)8-11/h5-6,8,12-13,16H,3-4,7,9-10H2,1-2H3,(H,17,20).
What are the key properties of N-(1-ethyl-6-oxo-3-pyridinyl)-4-(propylamino)oxolane-3-carboxamide?
N-(1-ethyl-6-oxo-3-pyridinyl)-4-(propylamino)oxolane-3-carboxamide has a molecular weight of 293.37 g/mol, XLogP of 0.82, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethyl-6-oxo-3-pyridinyl)-4-(propylamino)oxolane-3-carboxamide is sourced from PubChem (CID 66256902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).