cyclopropyl-[3-[(2-pyridin-4-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]methanone

C18H19N3O2 — CID 118676010

IUPACcyclopropyl-[3-[(2-pyridin-4-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]methanone
SMILESO=C(C1CC1)N1CCC(Oc2cccnc2-c2ccncc2)C1
InChIInChI=1S/C18H19N3O2/c22-18(14-3-4-14)21-11-7-15(12-21)23-16-2-1-8-20-17(16)13-5-9-19-10-6-13/h1-2,5-6,8-10,14-15H,3-4,7,11-12H2
InChIKeyQXHUDPZIDCWIDJ-UHFFFAOYSA-N
MW309.37 g/mol
LogP2.53
Rot. Bonds4

About cyclopropyl-[3-[(2-pyridin-4-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]methanone

cyclopropyl-[3-[(2-pyridin-4-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]methanone (PubChem CID 118676010) has the molecular formula C18H19N3O2 and a molecular weight of 309.37 g/mol. Its IUPAC name is cyclopropyl-[3-[(2-pyridin-4-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]methanone.

Molecular Properties

Compound Namecyclopropyl-[3-[(2-pyridin-4-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]methanone
PubChem CID118676010
Molecular FormulaC18H19N3O2
Molecular Weight309.37 g/mol
Exact Mass309.15
IUPAC Namecyclopropyl-[3-[(2-pyridin-4-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]methanone
SMILESO=C(C1CC1)N1CCC(Oc2cccnc2-c2ccncc2)C1
InChIInChI=1S/C18H19N3O2/c22-18(14-3-4-14)21-11-7-15(12-21)23-16-2-1-8-20-17(16)13-5-9-19-10-6-13/h1-2,5-6,8-10,14-15H,3-4,7,11-12H2
InChIKeyQXHUDPZIDCWIDJ-UHFFFAOYSA-N
XLogP2.53
TPSA55.32 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.37
LogP ≤ 52.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

cyclopropyl-(3-pyrimidin-2-yloxypyrrolidin-1-yl)methanone
CID 122243258
4-[3-[(2-pyridin-4-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]sulfonylmorpholine
CID 118675921
1-[3-[3-[[2-(dimethylamino)-3-pyridinyl]oxy]pyrrolidine-1-carbonyl]pyrrolidin-1-yl]ethanone
CID 128965218
1-[(3R)-3-[(3R)-3-[[2-(dimethylamino)-3-pyridinyl]oxy]pyrrolidine-1-carbonyl]pyrrolidin-1-yl]ethanone
CID 129340088
pyrazin-2-yl-[(3R)-3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]methanone
CID 129472960
2-[(3R)-1-(oxane-4-carbonyl)pyrrolidin-3-yl]oxypyridine-3-carboxamide
CID 71145261
[4-[(3-bromo-2-pyridinyl)oxy]piperidin-1-yl]-cyclopropylmethanone
CID 71799453
(3-fluoro-4-pyridinyl)-[(3S)-3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]methanone
CID 129476479
[3-[(3-bromo-2-pyridinyl)oxy]azetidin-1-yl]-cyclopropylmethanone
CID 122249860
[(3R)-3-[[2-(dimethylamino)-3-pyridinyl]oxy]pyrrolidin-1-yl]-pyrazin-2-ylmethanone
CID 129475193
3-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]oxy-2-pyridin-4-ylpyridine
CID 118675992
[(3S)-3-pyrazin-2-yloxypyrrolidin-1-yl]-pyridin-2-ylmethanone
CID 100753458

Frequently Asked Questions

What is the IUPAC name of cyclopropyl-[3-[(2-pyridin-4-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]methanone?
The IUPAC name of cyclopropyl-[3-[(2-pyridin-4-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]methanone (CID 118676010) is cyclopropyl-[3-[(2-pyridin-4-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]methanone.
What is the SMILES notation for cyclopropyl-[3-[(2-pyridin-4-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]methanone?
The canonical SMILES for cyclopropyl-[3-[(2-pyridin-4-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]methanone is O=C(C1CC1)N1CCC(Oc2cccnc2-c2ccncc2)C1.
What is the InChIKey of cyclopropyl-[3-[(2-pyridin-4-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]methanone?
The InChIKey is QXHUDPZIDCWIDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O2/c22-18(14-3-4-14)21-11-7-15(12-21)23-16-2-1-8-20-17(16)13-5-9-19-10-6-13/h1-2,5-6,8-10,14-15H,3-4,7,11-12H2.
What are the key properties of cyclopropyl-[3-[(2-pyridin-4-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]methanone?
cyclopropyl-[3-[(2-pyridin-4-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]methanone has a molecular weight of 309.37 g/mol, XLogP of 2.53, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropyl-[3-[(2-pyridin-4-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]methanone is sourced from PubChem (CID 118676010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).