furan-2-yl-[(2R,3R)-2-[(1-methylpyrazol-4-yl)methyl]-3-morpholin-4-ylpyrrolidin-1-yl]methanone

C18H24N4O3 — CID 125215138

IUPACfuran-2-yl-[(2R,3R)-2-[(1-methylpyrazol-4-yl)methyl]-3-morpholin-4-ylpyrrolidin-1-yl]methanone
SMILESCn1cc(C[C@@H]2[C@H](N3CCOCC3)CCN2C(=O)c2ccco2)cn1
InChIInChI=1S/C18H24N4O3/c1-20-13-14(12-19-20)11-16-15(21-6-9-24-10-7-21)4-5-22(16)18(23)17-3-2-8-25-17/h2-3,8,12-13,15-16H,4-7,9-11H2,1H3/t15-,16-/m1/s1
InChIKeyKOELXAJDIBLBNN-HZPDHXFCSA-N
MW344.41 g/mol
LogP1.17
Rot. Bonds4

About furan-2-yl-[(2R,3R)-2-[(1-methylpyrazol-4-yl)methyl]-3-morpholin-4-ylpyrrolidin-1-yl]methanone

furan-2-yl-[(2R,3R)-2-[(1-methylpyrazol-4-yl)methyl]-3-morpholin-4-ylpyrrolidin-1-yl]methanone (PubChem CID 125215138) has the molecular formula C18H24N4O3 and a molecular weight of 344.41 g/mol. Its IUPAC name is furan-2-yl-[(2R,3R)-2-[(1-methylpyrazol-4-yl)methyl]-3-morpholin-4-ylpyrrolidin-1-yl]methanone.

Molecular Properties

Compound Namefuran-2-yl-[(2R,3R)-2-[(1-methylpyrazol-4-yl)methyl]-3-morpholin-4-ylpyrrolidin-1-yl]methanone
PubChem CID125215138
Molecular FormulaC18H24N4O3
Molecular Weight344.41 g/mol
Exact Mass344.18
IUPAC Namefuran-2-yl-[(2R,3R)-2-[(1-methylpyrazol-4-yl)methyl]-3-morpholin-4-ylpyrrolidin-1-yl]methanone
SMILESCn1cc(C[C@@H]2[C@H](N3CCOCC3)CCN2C(=O)c2ccco2)cn1
InChIInChI=1S/C18H24N4O3/c1-20-13-14(12-19-20)11-16-15(21-6-9-24-10-7-21)4-5-22(16)18(23)17-3-2-8-25-17/h2-3,8,12-13,15-16H,4-7,9-11H2,1H3/t15-,16-/m1/s1
InChIKeyKOELXAJDIBLBNN-HZPDHXFCSA-N
XLogP1.17
TPSA63.74 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.41
LogP ≤ 51.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Launch Full Analysis

Related Compounds

[(2S,3R)-2-benzyl-3-morpholin-4-ylpyrrolidin-1-yl]-(furan-2-yl)methanone
CID 97384312
furan-2-yl-[(2R,3S)-3-morpholin-4-yl-2-(pyridin-3-ylmethyl)pyrrolidin-1-yl]methanone
CID 124787611
furan-2-yl-[(2S,3R)-3-morpholin-4-yl-2-(pyridin-4-ylmethyl)pyrrolidin-1-yl]methanone
CID 97471088
[(2S,3R)-2-[(1-methylpyrazol-4-yl)methyl]-3-morpholin-4-ylpyrrolidin-1-yl]-(1H-pyrrol-2-yl)methanone
CID 97471026
[(3aR,6aS)-1-[(1-methylpyrazol-4-yl)methyl]-2,3,3a,5,6,6a-hexahydropyrrolo[3,2-b]pyrrol-4-yl]-(furan-2-yl)methanone
CID 97459164
[(2R,3S)-2-benzyl-3-morpholin-4-ylpyrrolidin-1-yl]-(2-methylfuran-3-yl)methanone
CID 124806862
4-[(2R,3S)-2-[(1-methylpyrazol-4-yl)methyl]-1-(oxan-4-yl)pyrrolidin-3-yl]morpholine
CID 124817489
4-[(2R,3S)-2-[(1-methylpyrazol-4-yl)methyl]-1-pyrimidin-2-ylpyrrolidin-3-yl]morpholine
CID 125192278
(3aR,6aS)-1-(furan-2-carbonyl)-4-(1-methylpyrazol-4-yl)-3,3a,6,6a-tetrahydro-2H-pyrrolo[3,2-b]pyrrol-5-one
CID 97386401
(2S,3R)-3-(4-methylpiperazin-1-yl)-2-[(1-methylpyrazol-4-yl)methyl]-N-propan-2-ylpyrrolidine-1-carboxamide
CID 97392122
[(2R,3S)-2-benzyl-3-morpholin-4-ylpyrrolidin-1-yl]-thiophen-3-ylmethanone
CID 124792962
[2-(chloromethyl)-3-methylpyrrolidin-1-yl]-(furan-2-yl)methanone
CID 102787065

Frequently Asked Questions

What is the IUPAC name of furan-2-yl-[(2R,3R)-2-[(1-methylpyrazol-4-yl)methyl]-3-morpholin-4-ylpyrrolidin-1-yl]methanone?
The IUPAC name of furan-2-yl-[(2R,3R)-2-[(1-methylpyrazol-4-yl)methyl]-3-morpholin-4-ylpyrrolidin-1-yl]methanone (CID 125215138) is furan-2-yl-[(2R,3R)-2-[(1-methylpyrazol-4-yl)methyl]-3-morpholin-4-ylpyrrolidin-1-yl]methanone.
What is the SMILES notation for furan-2-yl-[(2R,3R)-2-[(1-methylpyrazol-4-yl)methyl]-3-morpholin-4-ylpyrrolidin-1-yl]methanone?
The canonical SMILES for furan-2-yl-[(2R,3R)-2-[(1-methylpyrazol-4-yl)methyl]-3-morpholin-4-ylpyrrolidin-1-yl]methanone is Cn1cc(C[C@@H]2[C@H](N3CCOCC3)CCN2C(=O)c2ccco2)cn1.
What is the InChIKey of furan-2-yl-[(2R,3R)-2-[(1-methylpyrazol-4-yl)methyl]-3-morpholin-4-ylpyrrolidin-1-yl]methanone?
The InChIKey is KOELXAJDIBLBNN-HZPDHXFCSA-N. The full InChI is InChI=1S/C18H24N4O3/c1-20-13-14(12-19-20)11-16-15(21-6-9-24-10-7-21)4-5-22(16)18(23)17-3-2-8-25-17/h2-3,8,12-13,15-16H,4-7,9-11H2,1H3/t15-,16-/m1/s1.
What are the key properties of furan-2-yl-[(2R,3R)-2-[(1-methylpyrazol-4-yl)methyl]-3-morpholin-4-ylpyrrolidin-1-yl]methanone?
furan-2-yl-[(2R,3R)-2-[(1-methylpyrazol-4-yl)methyl]-3-morpholin-4-ylpyrrolidin-1-yl]methanone has a molecular weight of 344.41 g/mol, XLogP of 1.17, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for furan-2-yl-[(2R,3R)-2-[(1-methylpyrazol-4-yl)methyl]-3-morpholin-4-ylpyrrolidin-1-yl]methanone is sourced from PubChem (CID 125215138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).