2-[1-(1-morpholin-4-yl-1-oxopropan-2-yl)pyrrolidin-2-yl]cyclopentan-1-one

C16H26N2O3 — CID 79539704

IUPAC2-[1-(1-morpholin-4-yl-1-oxopropan-2-yl)pyrrolidin-2-yl]cyclopentan-1-one
SMILESCC(C(=O)N1CCOCC1)N1CCCC1C1CCCC1=O
InChIInChI=1S/C16H26N2O3/c1-12(16(20)17-8-10-21-11-9-17)18-7-3-5-14(18)13-4-2-6-15(13)19/h12-14H,2-11H2,1H3
InChIKeyXGRGKDKLWOGCQX-UHFFFAOYSA-N
MW294.40 g/mol
LogP1.07
Rot. Bonds3

About 2-[1-(1-morpholin-4-yl-1-oxopropan-2-yl)pyrrolidin-2-yl]cyclopentan-1-one

2-[1-(1-morpholin-4-yl-1-oxopropan-2-yl)pyrrolidin-2-yl]cyclopentan-1-one (PubChem CID 79539704) has the molecular formula C16H26N2O3 and a molecular weight of 294.40 g/mol. Its IUPAC name is 2-[1-(1-morpholin-4-yl-1-oxopropan-2-yl)pyrrolidin-2-yl]cyclopentan-1-one.

Molecular Properties

Compound Name2-[1-(1-morpholin-4-yl-1-oxopropan-2-yl)pyrrolidin-2-yl]cyclopentan-1-one
PubChem CID79539704
Molecular FormulaC16H26N2O3
Molecular Weight294.40 g/mol
Exact Mass294.19
IUPAC Name2-[1-(1-morpholin-4-yl-1-oxopropan-2-yl)pyrrolidin-2-yl]cyclopentan-1-one
SMILESCC(C(=O)N1CCOCC1)N1CCCC1C1CCCC1=O
InChIInChI=1S/C16H26N2O3/c1-12(16(20)17-8-10-21-11-9-17)18-7-3-5-14(18)13-4-2-6-15(13)19/h12-14H,2-11H2,1H3
InChIKeyXGRGKDKLWOGCQX-UHFFFAOYSA-N
XLogP1.07
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.40
LogP ≤ 51.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[1-(1-morpholin-4-yl-1-oxopropan-2-yl)pyrrolidin-2-yl]cyclopentan-1-one?
The IUPAC name of 2-[1-(1-morpholin-4-yl-1-oxopropan-2-yl)pyrrolidin-2-yl]cyclopentan-1-one (CID 79539704) is 2-[1-(1-morpholin-4-yl-1-oxopropan-2-yl)pyrrolidin-2-yl]cyclopentan-1-one.
What is the SMILES notation for 2-[1-(1-morpholin-4-yl-1-oxopropan-2-yl)pyrrolidin-2-yl]cyclopentan-1-one?
The canonical SMILES for 2-[1-(1-morpholin-4-yl-1-oxopropan-2-yl)pyrrolidin-2-yl]cyclopentan-1-one is CC(C(=O)N1CCOCC1)N1CCCC1C1CCCC1=O.
What is the InChIKey of 2-[1-(1-morpholin-4-yl-1-oxopropan-2-yl)pyrrolidin-2-yl]cyclopentan-1-one?
The InChIKey is XGRGKDKLWOGCQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O3/c1-12(16(20)17-8-10-21-11-9-17)18-7-3-5-14(18)13-4-2-6-15(13)19/h12-14H,2-11H2,1H3.
What are the key properties of 2-[1-(1-morpholin-4-yl-1-oxopropan-2-yl)pyrrolidin-2-yl]cyclopentan-1-one?
2-[1-(1-morpholin-4-yl-1-oxopropan-2-yl)pyrrolidin-2-yl]cyclopentan-1-one has a molecular weight of 294.40 g/mol, XLogP of 1.07, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(1-morpholin-4-yl-1-oxopropan-2-yl)pyrrolidin-2-yl]cyclopentan-1-one is sourced from PubChem (CID 79539704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).