N-[(3S,4S)-4-methoxy-1-propan-2-ylpyrrolidin-3-yl]-2,5-dimethylfuran-3-carboxamide

C15H24N2O3 — CID 118784158

IUPACN-[(3S,4S)-4-methoxy-1-propan-2-ylpyrrolidin-3-yl]-2,5-dimethylfuran-3-carboxamide
SMILESCO[C@H]1CN(C(C)C)C[C@@H]1NC(=O)c1cc(C)oc1C
InChIInChI=1S/C15H24N2O3/c1-9(2)17-7-13(14(8-17)19-5)16-15(18)12-6-10(3)20-11(12)4/h6,9,13-14H,7-8H2,1-5H3,(H,16,18)/t13-,14-/m0/s1
InChIKeyZOYBLFWCOSVDLF-KBPBESRZSA-N
MW280.37 g/mol
LogP1.73
Rot. Bonds4

About N-[(3S,4S)-4-methoxy-1-propan-2-ylpyrrolidin-3-yl]-2,5-dimethylfuran-3-carboxamide

N-[(3S,4S)-4-methoxy-1-propan-2-ylpyrrolidin-3-yl]-2,5-dimethylfuran-3-carboxamide (PubChem CID 118784158) has the molecular formula C15H24N2O3 and a molecular weight of 280.37 g/mol. Its IUPAC name is N-[(3S,4S)-4-methoxy-1-propan-2-ylpyrrolidin-3-yl]-2,5-dimethylfuran-3-carboxamide.

Molecular Properties

Compound NameN-[(3S,4S)-4-methoxy-1-propan-2-ylpyrrolidin-3-yl]-2,5-dimethylfuran-3-carboxamide
PubChem CID118784158
Molecular FormulaC15H24N2O3
Molecular Weight280.37 g/mol
Exact Mass280.18
IUPAC NameN-[(3S,4S)-4-methoxy-1-propan-2-ylpyrrolidin-3-yl]-2,5-dimethylfuran-3-carboxamide
SMILESCO[C@H]1CN(C(C)C)C[C@@H]1NC(=O)c1cc(C)oc1C
InChIInChI=1S/C15H24N2O3/c1-9(2)17-7-13(14(8-17)19-5)16-15(18)12-6-10(3)20-11(12)4/h6,9,13-14H,7-8H2,1-5H3,(H,16,18)/t13-,14-/m0/s1
InChIKeyZOYBLFWCOSVDLF-KBPBESRZSA-N
XLogP1.73
TPSA54.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[(3S,4S)-4-methoxy-1-propan-2-ylpyrrolidin-3-yl]-2,5-dimethylfuran-3-carboxamide with MolForge

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Related Compounds

N-[(4S)-4-methoxypyrrolidin-3-yl]-2,5-dimethylfuran-3-carboxamide
CID 43594107
N-[(3S,4S)-4-methoxy-1-propan-2-ylpyrrolidin-3-yl]-2,6-dimethylquinoline-4-carboxamide
CID 70765038
3-fluoro-N-[(3S,4S)-4-methoxy-1-propan-2-ylpyrrolidin-3-yl]-4-methylbenzamide
CID 118792832
2,5-dimethyl-N-[(1R,2R)-2-methylcyclohexyl]furan-3-carboxamide
CID 7028594
5-chloro-N-[(3R,4R)-4-methoxy-1-propan-2-ylpyrrolidin-3-yl]-6-oxo-1H-pyridine-3-carboxamide
CID 133260540
1-[(3S,4S)-4-methoxy-1-propan-2-ylpyrrolidin-3-yl]-3-(5-methyl-2-propan-2-ylpyrazol-3-yl)urea
CID 72886030
2-amino-N-[(3S,4S)-4-methoxy-1-propan-2-ylpyrrolidin-3-yl]-4-phenylpyrimidine-5-carboxamide
CID 118769446
N-[(3R,4R)-4-methoxy-1-propan-2-ylpyrrolidin-3-yl]-2-(2-methyl-1,3-thiazol-4-yl)-6-oxo-1H-pyrimidine-5-carboxamide
CID 133132474
N-[(3R,4R)-4-methoxy-1-propan-2-ylpyrrolidin-3-yl]-2-methyl-3-(pyridin-2-ylmethylamino)benzamide
CID 133120656
N-[1-(2-methoxyethyl)piperidin-4-yl]-2,5-dimethylfuran-3-carboxamide
CID 71784704
N-methoxy-2,5-dimethylfuran-3-carboxamide
CID 60716938
2,5-dimethyl-N-pyrrolidin-3-ylfuran-3-carboxamide
CID 43603617

Frequently Asked Questions

What is the IUPAC name of N-[(3S,4S)-4-methoxy-1-propan-2-ylpyrrolidin-3-yl]-2,5-dimethylfuran-3-carboxamide?
The IUPAC name of N-[(3S,4S)-4-methoxy-1-propan-2-ylpyrrolidin-3-yl]-2,5-dimethylfuran-3-carboxamide (CID 118784158) is N-[(3S,4S)-4-methoxy-1-propan-2-ylpyrrolidin-3-yl]-2,5-dimethylfuran-3-carboxamide.
What is the SMILES notation for N-[(3S,4S)-4-methoxy-1-propan-2-ylpyrrolidin-3-yl]-2,5-dimethylfuran-3-carboxamide?
The canonical SMILES for N-[(3S,4S)-4-methoxy-1-propan-2-ylpyrrolidin-3-yl]-2,5-dimethylfuran-3-carboxamide is CO[C@H]1CN(C(C)C)C[C@@H]1NC(=O)c1cc(C)oc1C.
What is the InChIKey of N-[(3S,4S)-4-methoxy-1-propan-2-ylpyrrolidin-3-yl]-2,5-dimethylfuran-3-carboxamide?
The InChIKey is ZOYBLFWCOSVDLF-KBPBESRZSA-N. The full InChI is InChI=1S/C15H24N2O3/c1-9(2)17-7-13(14(8-17)19-5)16-15(18)12-6-10(3)20-11(12)4/h6,9,13-14H,7-8H2,1-5H3,(H,16,18)/t13-,14-/m0/s1.
What are the key properties of N-[(3S,4S)-4-methoxy-1-propan-2-ylpyrrolidin-3-yl]-2,5-dimethylfuran-3-carboxamide?
N-[(3S,4S)-4-methoxy-1-propan-2-ylpyrrolidin-3-yl]-2,5-dimethylfuran-3-carboxamide has a molecular weight of 280.37 g/mol, XLogP of 1.73, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3S,4S)-4-methoxy-1-propan-2-ylpyrrolidin-3-yl]-2,5-dimethylfuran-3-carboxamide is sourced from PubChem (CID 118784158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).