morpholin-4-yl-[1-[1-(2,2,3,3-tetramethylcyclopropanecarbonyl)piperidin-4-yl]piperidin-4-yl]methanone

C23H39N3O3 — CID 25368630

IUPACmorpholin-4-yl-[1-[1-(2,2,3,3-tetramethylcyclopropanecarbonyl)piperidin-4-yl]piperidin-4-yl]methanone
SMILESCC1(C)C(C(=O)N2CCC(N3CCC(C(=O)N4CCOCC4)CC3)CC2)C1(C)C
InChIInChI=1S/C23H39N3O3/c1-22(2)19(23(22,3)4)21(28)25-11-7-18(8-12-25)24-9-5-17(6-10-24)20(27)26-13-15-29-16-14-26/h17-19H,5-16H2,1-4H3
InChIKeyRNEOUFSWXNFFED-UHFFFAOYSA-N
MW405.58 g/mol
LogP2.23
Rot. Bonds3

About morpholin-4-yl-[1-[1-(2,2,3,3-tetramethylcyclopropanecarbonyl)piperidin-4-yl]piperidin-4-yl]methanone

morpholin-4-yl-[1-[1-(2,2,3,3-tetramethylcyclopropanecarbonyl)piperidin-4-yl]piperidin-4-yl]methanone (PubChem CID 25368630) has the molecular formula C23H39N3O3 and a molecular weight of 405.58 g/mol. Its IUPAC name is morpholin-4-yl-[1-[1-(2,2,3,3-tetramethylcyclopropanecarbonyl)piperidin-4-yl]piperidin-4-yl]methanone.

Molecular Properties

Compound Namemorpholin-4-yl-[1-[1-(2,2,3,3-tetramethylcyclopropanecarbonyl)piperidin-4-yl]piperidin-4-yl]methanone
PubChem CID25368630
Molecular FormulaC23H39N3O3
Molecular Weight405.58 g/mol
Exact Mass405.30
IUPAC Namemorpholin-4-yl-[1-[1-(2,2,3,3-tetramethylcyclopropanecarbonyl)piperidin-4-yl]piperidin-4-yl]methanone
SMILESCC1(C)C(C(=O)N2CCC(N3CCC(C(=O)N4CCOCC4)CC3)CC2)C1(C)C
InChIInChI=1S/C23H39N3O3/c1-22(2)19(23(22,3)4)21(28)25-11-7-18(8-12-25)24-9-5-17(6-10-24)20(27)26-13-15-29-16-14-26/h17-19H,5-16H2,1-4H3
InChIKeyRNEOUFSWXNFFED-UHFFFAOYSA-N
XLogP2.23
TPSA53.09 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.58
LogP ≤ 52.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of morpholin-4-yl-[1-[1-(2,2,3,3-tetramethylcyclopropanecarbonyl)piperidin-4-yl]piperidin-4-yl]methanone?
The IUPAC name of morpholin-4-yl-[1-[1-(2,2,3,3-tetramethylcyclopropanecarbonyl)piperidin-4-yl]piperidin-4-yl]methanone (CID 25368630) is morpholin-4-yl-[1-[1-(2,2,3,3-tetramethylcyclopropanecarbonyl)piperidin-4-yl]piperidin-4-yl]methanone.
What is the SMILES notation for morpholin-4-yl-[1-[1-(2,2,3,3-tetramethylcyclopropanecarbonyl)piperidin-4-yl]piperidin-4-yl]methanone?
The canonical SMILES for morpholin-4-yl-[1-[1-(2,2,3,3-tetramethylcyclopropanecarbonyl)piperidin-4-yl]piperidin-4-yl]methanone is CC1(C)C(C(=O)N2CCC(N3CCC(C(=O)N4CCOCC4)CC3)CC2)C1(C)C.
What is the InChIKey of morpholin-4-yl-[1-[1-(2,2,3,3-tetramethylcyclopropanecarbonyl)piperidin-4-yl]piperidin-4-yl]methanone?
The InChIKey is RNEOUFSWXNFFED-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H39N3O3/c1-22(2)19(23(22,3)4)21(28)25-11-7-18(8-12-25)24-9-5-17(6-10-24)20(27)26-13-15-29-16-14-26/h17-19H,5-16H2,1-4H3.
What are the key properties of morpholin-4-yl-[1-[1-(2,2,3,3-tetramethylcyclopropanecarbonyl)piperidin-4-yl]piperidin-4-yl]methanone?
morpholin-4-yl-[1-[1-(2,2,3,3-tetramethylcyclopropanecarbonyl)piperidin-4-yl]piperidin-4-yl]methanone has a molecular weight of 405.58 g/mol, XLogP of 2.23, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for morpholin-4-yl-[1-[1-(2,2,3,3-tetramethylcyclopropanecarbonyl)piperidin-4-yl]piperidin-4-yl]methanone is sourced from PubChem (CID 25368630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).